Isocyanates

Alfa Aesar™ Isophorone diisocyanate, mixture of isomers, 98%

Alfa Aesar™ Isophorone diisocyanate, mixture of isomers, 98%

CAS: 4098-71-9 Molecular Formula: C12H18N2O2 Molecular Weight (g/mol): 222.288 MDL Number: MFCD00064956 InChI Key: NIMLQBUJDJZYEJ-UHFFFAOYSA-N Synonym: isophorone diisocyanate, ipdi, isophorone diamine diisocyanate, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane, 3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate, cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl, 3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, ccris 6252, isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester, isophorone diisocyanate diisocyanates PubChem CID: 169132 ChEBI: CHEBI:53214 IUPAC Name: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane SMILES: CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C

Isophorone diisocyanate, 98%, ACROS Organics™

Isophorone diisocyanate, 98%, ACROS Organics™

CAS: 4098-71-9 Molecular Formula: C12H18N2O2 Molecular Weight (g/mol): 222.28 MDL Number: MFCD00064956 InChI Key: NIMLQBUJDJZYEJ-UHFFFAOYSA-N Synonym: isophorone diisocyanate, ipdi, isophorone diamine diisocyanate, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethylcyclohexane, 3-isocyanatomethyl-3,5,5-trimethylcyclohexylisocyanate, cyclohexane, 5-isocyanato-1-isocyanatomethyl-1,3,3-trimethyl, 3-isocyanatomethyl-3,5,5-trimethylcyclohexyl isocyanate, ccris 6252, isocyanic acid, methylene 3,5,5-trimethyl-3,1-cyclohexylene ester, isophorone diisocyanate diisocyanates PubChem CID: 169132 ChEBI: CHEBI:53214 IUPAC Name: 5-isocyanato-1-(isocyanatomethyl)-1,3,3-trimethylcyclohexane SMILES: CC1(CC(CC(C1)(C)CN=C=O)N=C=O)C

Alfa Aesar™ m-Tolyl isocyanate, 99%

Alfa Aesar™ m-Tolyl isocyanate, 99%

CAS: 621-29-4 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00002021 InChI Key: CPPGZWWUPFWALU-UHFFFAOYSA-N Synonym: m-tolyl isocyanate, benzene, 1-isocyanato-3-methyl, meta-tolyl isocyanate, m-tolylisocyanate, m-isocyanatotoluene, 3-methylphenyl isocyanate, 3-tolyl isocyanate, 3-methylphenylisocyanate, 1-isocyanato-3-methyl-benzene, m-methylphenyl isocyanate PubChem CID: 69303 IUPAC Name: 1-isocyanato-3-methylbenzene SMILES: CC1=CC=CC(=C1)N=C=O

4-Cyanophenyl isocyanate, 95%, ACROS Organics™

4-Cyanophenyl isocyanate, 95%, ACROS Organics™

CAS: 40465-45-0 Molecular Formula: C8H4N2O Molecular Weight (g/mol): 144.13 MDL Number: MFCD00037038 InChI Key: TVSXDZNUTPLDKY-UHFFFAOYSA-N Synonym: 4-cyanophenyl isocyanate, benzonitrile, 4-isocyanato, 4-cyanophenylisocyanate, p-cyanophenyl isocyanate, benzonitrile,4-isocyanato, 4-isocyanatobenzenecarbonitrile, 4-cyanophenylisocyanat, p-cyanophenylisocyanate, #, 1-cyano-4-isocyanato-benzene PubChem CID: 170380 IUPAC Name: 4-isocyanatobenzonitrile SMILES: C1=CC(=CC=C1C#N)N=C=O

(S)-(-)-α-Methylbenzyl isocyanate, 98%, ACROS Organics™

(S)-(-)-α-Methylbenzyl isocyanate, 98%, ACROS Organics™

CAS: 14649-03-7 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.18 MDL Number: MFCD00002036 InChI Key: JJSCUXAFAJEQGB-QMMMGPOBSA-N Synonym: s---1-phenylethyl isocyanate, 1s-1-isocyanatoethyl benzene, s---alpha-methylbenzyl isocyanate, benzene, 1s-1-isocyanatoethyl, isocyanic acid s---a-methylbenzyl ester, s-alpha-methylbenzyl isocyanate, s---1-phenylethylisocyanate, isocyanic acid s---alpha-methylbenzyl ester, isocyanic acid s---methylbenzyl ester, 1-isocyanatoethyl benzene # PubChem CID: 2724173 IUPAC Name: [(1S)-1-isocyanatoethyl]benzene SMILES: CC(C1=CC=CC=C1)N=C=O

4-(4-Isocyanatophenoxy)tetrahydropyran, 97%, Maybridge™

4-(4-Isocyanatophenoxy)tetrahydropyran, 97%, Maybridge™

CAS: 892501-94-9 Molecular Formula: C12H13NO3 Molecular Weight (g/mol): 219.24 MDL Number: MFCD09702366 InChI Key: ZGNHUEWFJQLPDN-UHFFFAOYSA-N Synonym: 4-4-isocyanatophenoxy oxane, 4-4-isocyanatophenoxy tetrahydropyran, 4-4-isocyanatophenoxy tetrahydro-2h-pyran, 2h-pyran,tetrahydro-4-4-isocyanatophenoxy, 4-tetrahydro-2h-pyran-4-yl oxy phenyl isocyanate, 1-isocyanato-4-tetrahydro-2h-pyran-4-yl oxy benzene, 4-2h-3,4,5,6-tetrahydropyran-4-yloxy benzenisocyanate PubChem CID: 24229521 IUPAC Name: 4-(4-isocyanatophenoxy)oxane SMILES: C1COCCC1OC2=CC=C(C=C2)N=C=O

Alfa Aesar™ 1,6-Diisocyanatohexane, 98+%

Alfa Aesar™ 1,6-Diisocyanatohexane, 98+%

CAS: 822-06-0 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00002047 InChI Key: RRAMGCGOFNQTLD-UHFFFAOYSA-N Synonym: hexamethylene diisocyanate, 1,6-hexamethylene diisocyanate, hmdi, hexane, 1,6-diisocyanato, hexane 1,6-diisocyanate, 1,6-hexylene diisocyanate, hexamethylene-1,6-diisocyanate, 1,6-hexanediol diisocyanate, hdi, isocyanic acid, hexamethylene ester PubChem CID: 13192 ChEBI: CHEBI:53578 IUPAC Name: 1,6-diisocyanatohexane SMILES: O=C=NCCCCCCN=C=O

2-Isocyanatobenzonitrile, 97%, Maybridge™

2-Isocyanatobenzonitrile, 97%, Maybridge™

CAS: 42066-86-4 Molecular Formula: C8H4N2O Molecular Weight (g/mol): 144.133 InChI Key: FQLNVWAFXQUXGW-UHFFFAOYSA-N Synonym: 2-cyanophenyl isocyanate, benzonitrile,2-isocyanato, 2-isocyanato-benzonitrile, 2-isocyanatobenzenecarbonitrile, 2-cyanophenylisocyanate, benzonitrile, 2-isocyanato, acmc-1ap1b PubChem CID: 2735873 IUPAC Name: 2-isocyanatobenzonitrile SMILES: C1=CC=C(C(=C1)C#N)N=C=O

p-Tolyl isocyanate, 99%, ACROS Organics™

p-Tolyl isocyanate, 99%, ACROS Organics™

CAS: 622-58-2 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 InChI Key: MGYGFNQQGAQEON-UHFFFAOYSA-N Synonym: p-tolyl isocyanate, 4-tolyl isocyanate, 4-methylphenyl isocyanate, p-isocyanatotoluene, 4-isocyanatotoluene, p-toluene isocyanate, p-methylphenyl isocyanate, benzene, 1-isocyanato-4-methyl, p-tolylisocyanate, 1-isocyanato-4-methyl-benzene PubChem CID: 69325 ChEBI: CHEBI:53732 IUPAC Name: 1-isocyanato-4-methylbenzene SMILES: CC1=CC=C(C=C1)N=C=O

Alfa Aesar™ Ethyl 3-isocyanatopropionate, 98%

Alfa Aesar™ Ethyl 3-isocyanatopropionate, 98%

CAS: 5100-34-5 Molecular Formula: C6H9NO3 Molecular Weight (g/mol): 143.14 MDL Number: MFCD00078461 InChI Key: XBSGYVHOINMTIM-UHFFFAOYSA-N Synonym: ethyl 3-isocyanatopropionate, propanoic acid, 3-isocyanato-, ethyl ester, 3-isocyanatopropionic acid ethyl ester, ethyl n-oxomethylidene-beta-alaninate, ethyl n-oxomethylene-beta-alaninate, acmc-20akzk, ethyl-3-isocyanatopropionate, ethyl 3-isocyanato-propionate, ethyl 3-isocyanatopropion-ate, ethyl-3-isocyanato-propionate PubChem CID: 2733373 IUPAC Name: ethyl 3-isocyanatopropanoate SMILES: CCOC(=O)CCN=C=O

Alfa Aesar™ 3,4-Dichlorophenyl isocyanate, 97%

Alfa Aesar™ 3,4-Dichlorophenyl isocyanate, 97%

CAS: 102-36-3 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00002017 InChI Key: MFUVCHZWGSJKEQ-UHFFFAOYSA-N Synonym: 3,4-dichlorophenyl isocyanate, benzene, 1,2-dichloro-4-isocyanato, 3,4-dichlorfenylisokyanat, isocyanic acid 3,4-dichlorophenyl ester, 3,4-dichlorophenylisocyanate, unii-ozw0b7f1du, 3,4-dichlorphenylisocyanate, isocyanic acid, 3,4-dichlorophenyl ester, 3,4-dichlorfenylisokyanat czech, ozw0b7f1du PubChem CID: 7607 IUPAC Name: 1,2-dichloro-4-isocyanatobenzene SMILES: C1=CC(=C(C=C1N=C=O)Cl)Cl

Alfa Aesar™ 4-Ethylphenyl isocyanate, 98%

Alfa Aesar™ 4-Ethylphenyl isocyanate, 98%

CAS: 23138-50-3 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00013881 InChI Key: FWPYUSLQCQDLJR-UHFFFAOYSA-N Synonym: 4-ethylphenyl isocyanate, p-ethylphenyl isocyanate, 4-ethylphenylisocyanate, benzene, 1-ethyl-4-isocyanato, benzene,1-ethyl-4-isocyanato, 4-ethylbenzenisocyanate, acmc-1cpzx, 4-ethyl phenylisocyanate, 4-ethyl-phenyl-isocyanate, 1-ethyl-4-isocyanato-benzene PubChem CID: 90007 IUPAC Name: 1-ethyl-4-isocyanatobenzene SMILES: CCC1=CC=C(C=C1)N=C=O

1,6-Diisocyanatohexane, 99+%, ACROS Organics™

1,6-Diisocyanatohexane, 99+%, ACROS Organics™

CAS: 822-06-0 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00002047 InChI Key: RRAMGCGOFNQTLD-UHFFFAOYSA-N Synonym: hexamethylene diisocyanate, 1,6-hexamethylene diisocyanate, hmdi, hexane, 1,6-diisocyanato, hexane 1,6-diisocyanate, 1,6-hexylene diisocyanate, hexamethylene-1,6-diisocyanate, 1,6-hexanediol diisocyanate, hdi, isocyanic acid, hexamethylene ester PubChem CID: 13192 ChEBI: CHEBI:53578 IUPAC Name: 1,6-diisocyanatohexane SMILES: O=C=NCCCCCCN=C=O

Octyl isocyanate, 99%, ACROS Organics™

Octyl isocyanate, 99%, ACROS Organics™

CAS: 3158-26-7 Molecular Formula: C9H17NO Molecular Weight (g/mol): 155.24 MDL Number: MFCD00013887 InChI Key: DYQFCTCUULUMTQ-UHFFFAOYSA-N Synonym: octyl isocyanate, octylisocyanate, octane, 1-isocyanato, n-octylisocyanate, 1-octyl isocyanate, n-octyl isocyanate, 1-isocyanato-octane, isocyanic acid, octyl ester, octanisocyanate PubChem CID: 76616 IUPAC Name: 1-isocyanatooctane SMILES: CCCCCCCCN=C=O

3-Isocyanato-5-methyl-2-phenylfuran, 97%, Maybridge™

3-Isocyanato-5-methyl-2-phenylfuran, 97%, Maybridge™

CAS: 898289-18-4 Molecular Formula: C12H9NO2 Molecular Weight (g/mol): 199.209 MDL Number: MFCD09025851 InChI Key: GDLFJANXKGIZKA-UHFFFAOYSA-N Synonym: 5-methyl-2-phenylfuran-3-isocyanate, furan,3-isocyanato-5-methyl-2-phenyl PubChem CID: 18525836 IUPAC Name: 3-isocyanato-5-methyl-2-phenylfuran SMILES: CC1=CC(=C(O1)C2=CC=CC=C2)N=C=O

Alfa Aesar™ 1,1,3,3-Tetramethylbutyl isocyanate, 98%

Alfa Aesar™ 1,1,3,3-Tetramethylbutyl isocyanate, 98%

CAS: 1611-57-0 Molecular Formula: C9H17NO Molecular Weight (g/mol): 155.24 MDL Number: MFCD00209615 InChI Key: XOHBENIMDRFUIH-UHFFFAOYSA-N Synonym: 1,1,3,3-tetramethylbutyl isocyanate, tert-octyl isocyanate, 2-isocyanato-2,4,4-trimethyl-pentane, pentane, 2-isocyanato-2,4,4-trimethyl, acmc-1bnst, pentane,2-isocyanato-2,4,4-trimethyl, unavailable-see asdi_catno 500009647, 1,1,3,3-tetramethylbutyl isocyanate∼2,4,4-trimethyl-2-pentyl isocyanate PubChem CID: 407498 IUPAC Name: 2-isocyanato-2,4,4-trimethylpentane SMILES: CC(C)(C)CC(C)(C)N=C=O

1-Naphthyl isocyanate, 99%, ACROS Organics™

1-Naphthyl isocyanate, 99%, ACROS Organics™

CAS: 86-84-0 Molecular Formula: C11H7NO Molecular Weight (g/mol): 169.18 InChI Key: BDQNKCYCTYYMAA-UHFFFAOYSA-N Synonym: 1-naphthyl isocyanate, naphthalene, 1-isocyanato, alpha-naphthyl isocyanate, isocyanatonaphthalene, 1-naphthylisocyanate, 1-isocyanato-naphthalene, unii-5lh2p0691e, 1-isocyanatonapthalene, isocyanic acid 1-naphthyl ester, isocyanic acid, 1-naphthyl ester PubChem CID: 66589 IUPAC Name: 1-isocyanatonaphthalene SMILES: C1=CC=C2C(=C1)C=CC=C2N=C=O

Hexyl isocyanate, 99%, ACROS Organics™

Hexyl isocyanate, 99%, ACROS Organics™

CAS: 2525-62-4 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.19 MDL Number: MFCD00037047 InChI Key: ANJPRQPHZGHVQB-UHFFFAOYSA-N Synonym: hexyl isocyanate, hexane, 1-isocyanato, 1-hexyl isocyanate, hexylmonoisocyanate, hexyl monoisocyanate, hexylisocyanate, n-hexyl isocyanate, hexanisocyanate, isocyanatohexane, isocyanato-hexane PubChem CID: 75659 ChEBI: CHEBI:59058 IUPAC Name: 1-isocyanatohexane SMILES: CCCCCCN=C=O

Alfa Aesar™ p-Tolyl isocyanate, 99%

Alfa Aesar™ p-Tolyl isocyanate, 99%

CAS: 622-58-2 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00002029 InChI Key: MGYGFNQQGAQEON-UHFFFAOYSA-N Synonym: p-tolyl isocyanate, 4-tolyl isocyanate, 4-methylphenyl isocyanate, p-isocyanatotoluene, 4-isocyanatotoluene, p-toluene isocyanate, p-methylphenyl isocyanate, benzene, 1-isocyanato-4-methyl, p-tolylisocyanate, 1-isocyanato-4-methyl-benzene PubChem CID: 69325 ChEBI: CHEBI:53732 IUPAC Name: 1-isocyanato-4-methylbenzene SMILES: CC1=CC=C(C=C1)N=C=O

Cyclopentyl isocyanate, 97%, ACROS Organics™

Cyclopentyl isocyanate, 97%, ACROS Organics™

CAS: 4747-71-1 Molecular Formula: C6H9NO Molecular Weight (g/mol): 111.14 MDL Number: MFCD02093695 InChI Key: CZALJDQHONFVFU-UHFFFAOYSA-N Synonym: cyclopentyl isocyanate, cyclopentylisocyanate, cyclopentane, isocyanato, isocyanic acid cyclopentyl ester, isocyanato cyclopentane, isocyanato-cyclopentane, acmc-1aspa, ksc497s6f PubChem CID: 643500 IUPAC Name: isocyanatocyclopentane SMILES: C1CCC(C1)N=C=O

Alfa Aesar™ Allyl isocyanate, 98%

Alfa Aesar™ Allyl isocyanate, 98%

CAS: 1476-23-9 Molecular Formula: C4H5NO Molecular Weight (g/mol): 83.09 MDL Number: MFCD00002044 InChI Key: HXBPYFMVGFDZFT-UHFFFAOYSA-N Synonym: allyl isocyanate, 1-propene, 3-isocyanato, 3-isocyanato-1-propene, propene, 3-isocyanato, allylisocyanate, isocyanic acid, allyl ester, 1-propene,3-isocyanato, prop-2-enisocyanate, 2-propenyl isocyanate, isocyanicacid,allylester PubChem CID: 15123 IUPAC Name: 3-isocyanatoprop-1-ene SMILES: C=CCN=C=O

2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl isocyanate, 97%, Maybridge™

2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-yl isocyanate, 97%, Maybridge™

CAS: 87254-55-5 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD09025825 InChI Key: JTJCJMYVKXVWIJ-UHFFFAOYSA-N Synonym: 2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl isocyanate, 7-isocyanato-2,2-dimethyl-2,3-dihydro-1-benzofuran, 2,2-dimethyl-2,3-dihydrobenzo b furan-7-isocyanate, benzofuran,2,3-dihydro-7-isocyanato-2,2-dimethyl PubChem CID: 18525712 IUPAC Name: 7-isocyanato-2,2-dimethyl-3H-1-benzofuran SMILES: CC1(CC2=C(O1)C(=CC=C2)N=C=O)C

Alfa Aesar™ 3-(Methoxycarbonyl)phenyl isocyanate, 97%

Alfa Aesar™ 3-(Methoxycarbonyl)phenyl isocyanate, 97%

CAS: 41221-47-0 Molecular Formula: C9H7NO3 Molecular Weight (g/mol): 177.16 MDL Number: MFCD00037077 InChI Key: WBGWGERFPSYHDT-UHFFFAOYSA-N Synonym: 3-carbomethoxyphenyl isocyanate, 3-isocyanatobenzoic acid methyl ester, benzoic acid, 3-isocyanato-, methyl ester, 3-methoxycarbonyl phenyl isocyanate, acmc-20akh8, methyl-3-isocyanatobenzoate, 3-carbomethoxyphenylisocyanate, methyl 3-isocyanatobenzoate, 3-isocyanato-benzoic acid methyl ester, m-methoxycarbonylphenyl isocyanate PubChem CID: 2733366 IUPAC Name: methyl 3-isocyanatobenzoate SMILES: COC(=O)C1=CC=CC(=C1)N=C=O

4-Isocyanato-5-methyl-1-phenyl-1H-pyrazole 97+%, Maybridge™

4-Isocyanato-5-methyl-1-phenyl-1H-pyrazole 97+%, Maybridge™

CAS: 799283-97-9 Molecular Formula: C11H9N3O Molecular Weight (g/mol): 199.213 InChI Key: IIFVDOYRTLEGHQ-UHFFFAOYSA-N Synonym: 4-isocyanato-5-methyl-1-phenyl-1h-pyrazole, 5-methyl-1-phenylpyrazol-4-isocyanate, 1h-pyrazole,4-isocyanato-5-methyl-1-phenyl, 5-methyl-1-phenyl-1h-pyrazol-4-yl isocyanate, 4-isocyanato-5-methyl-1h-pyrazol-4-yl benzene PubChem CID: 7164551 IUPAC Name: 4-isocyanato-5-methyl-1-phenylpyrazole SMILES: CC1=C(C=NN1C2=CC=CC=C2)N=C=O

1-Benzothiophen-5-yl isocyanate, 97%, Maybridge™

1-Benzothiophen-5-yl isocyanate, 97%, Maybridge™

CAS: 239097-78-0 Molecular Formula: C9H5NOS Molecular Weight (g/mol): 175.205 InChI Key: GWLZJAWTWVSHCU-UHFFFAOYSA-N Synonym: 1-benzothiophen-5-yl isocyanate, 1-benzothiophen-5-ylisocyanate, benzo b thiophen-5-isocyanate, 5-isocyanato-benzo b thiophene, benzo b thiophene,5-isocyanato PubChem CID: 7060535 IUPAC Name: 5-isocyanato-1-benzothiophene SMILES: C1=CC2=C(C=CS2)C=C1N=C=O

4,4'-Methylenebis(cyclohexyl isocyanate), 90%, mixture of isomers, AcroSeal™, ACROS Organics™

4,4'-Methylenebis(cyclohexyl isocyanate), 90%, mixture of isomers, AcroSeal™, ACROS Organics™

CAS: 5124-30-1 Molecular Formula: C15H22N2O2 Molecular Weight (g/mol): 262.35 MDL Number: MFCD00015405 InChI Key: KORSJDCBLAPZEQ-UHFFFAOYSA-N Synonym: hydrogenated mdi, hylene w, bis 4-isocyanatocyclohexyl methane, 4,4'-diisocyanatodicyclohexylmethane, methylene bis 4-cyclohexylisocyanate, dicyclohexylmethane 4,4'-diisocyanate, dicyclohexylmethane-4,4'-diisocyanate, methylene bis-4-cyclohexylisocyanate, nacconate h 12, cyclohexane, 1,1'-methylenebis 4-isocyanato PubChem CID: 21202 ChEBI: CHEBI:53216 IUPAC Name: 1-isocyanato-4-[(4-isocyanatocyclohexyl)methyl]cyclohexane SMILES: O=C=NC1CCC(CC2CCC(CC2)N=C=O)CC1

Alfa Aesar™ 2,4-Dichlorophenyl isocyanate, 96%

Alfa Aesar™ 2,4-Dichlorophenyl isocyanate, 96%

CAS: 2612-57-9 Molecular Formula: C7H3Cl2NO Molecular Weight (g/mol): 188.007 MDL Number: MFCD00002001 InChI Key: OLBJNSPBWLCTOT-UHFFFAOYSA-N Synonym: 2,4-dichlorophenyl isocyanate, 2,4-dichlorophenylisocyanate, benzene, 2,4-dichloro-1-isocyanato, 2,4-dichlorophenyl isocyantae, 2,4-dichlorobenzenisocyanate, acmc-1cg9n, 2,4-dichlorphenyl isocyanate, 2,4-dichloro phenyl isocyanate, # PubChem CID: 75789 IUPAC Name: 2,4-dichloro-1-isocyanatobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)N=C=O

3-Cyanophenyl isocyanate, 97%, ACROS Organics™

3-Cyanophenyl isocyanate, 97%, ACROS Organics™

CAS: 16413-26-6 Molecular Formula: C8H4N2O Molecular Weight (g/mol): 144.13 MDL Number: MFCD00013856 InChI Key: NZHPVPMRNASEQK-UHFFFAOYSA-N Synonym: 3-cyanophenyl isocyanate, 3-cyanophenylisocyanate, benzonitrile, 3-isocyanato, 3-isocyanatobenzenecarbonitrile, m-cyanophenyl isocyanate, m-cyanophenylisocyanate, pubchem5028, 3-isocyanato-benzonitrile, acmc-1c7a7, paragos 331038 PubChem CID: 2733315 IUPAC Name: 3-isocyanatobenzonitrile SMILES: C1=CC(=CC(=C1)N=C=O)C#N

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