2-halobenzoic acids and derivatives

Alfa Aesar™ 1-(2-Fluorobenzoyl)pyrrolidine, 97%

CAS: 347909-09-5 Molecular Formula: C11H12FNO Molecular Weight (g/mol): 193.221 MDL Number: MFCD00460952 InChI Key: AZBXHPRYPHBYCV-UHFFFAOYSA-N Synonym: 1-2-fluorobenzoyl pyrrolidine, 2-fluorophenyl 1-pyrrolidinyl methanone, 2-fluorophenyl-pyrrolidin-1-ylmethanone PubChem CID: 3497148 IUPAC Name: (2-fluorophenyl)-pyrrolidin-1-ylmethanone SMILES: C1CCN(C1)C(=O)C2=CC=CC=C2F

2-Iodosobenzoic acid, 98%, ACROS Organics™

CAS: 304-91-6 Molecular Formula: C7H5IO3 Molecular Weight (g/mol): 264.02 InChI Key: IFPHDUVGLXEIOQ-UHFFFAOYSA-N Synonym: 2-iodosobenzoic acid, o-iodosobenzoic acid, o-iodosylbenzoic acid, o-iodosobenzoate, benzoic acid, 2-iodosyl, benzoic acid, o-iodoso, 2-iodosyl benzoate, benzoic acid, iodosyl, ortho-iodosylbenzoic acid, 3h-1,2-benziodoxol-1-ium, 3-oxo-, hydroxide PubChem CID: 67537 ChEBI: CHEBI:52698 IUPAC Name: 2-iodosylbenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I=O

Alfa Aesar™ 4-Carboxy-3-chlorobenzeneboronic acid, 97%

CAS: 136496-72-5 Molecular Formula: C7H6BClO4 Molecular Weight (g/mol): 200.381 MDL Number: MFCD06656268 InChI Key: QFAFGWXQNDYXPZ-UHFFFAOYSA-N Synonym: 4-carboxy-3-chlorophenylboronic acid, 3-chloro-4-carboxyphenylboronic acid, 4-carboxy-3-chlorobenzeneboronic acid, 2-chloro-4-dihydroxyboranyl benzoic acid, 4-carboxy-3-chlorobenzeneboronicacid, pubchem5134, 4-carboxy-3, akos brn-0544, acmc-1cuk9, ksc174k1d PubChem CID: 14903223 IUPAC Name: 4-borono-2-chlorobenzoic acid SMILES: B(C1=CC(=C(C=C1)C(=O)O)Cl)(O)O

Alfa Aesar™ 2-Bromo-5-chlorobenzoic acid, 98+%

CAS: 21739-93-5 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00013982 InChI Key: RBCPJQQJBAQSOU-UHFFFAOYSA-N Synonym: 6-bromo-3-chlorobenzoic acid, benzoic acid, 2-bromo-5-chloro, 2-bromo-5-chloro-benzoic acid, 5-chloro-2-bromobenzoic acid, pubchem3584, acmc-1co7w, 2-bromo-5-chlorobenzoicacid, ksc204k2j, benzoicacid, 2-bromo-5-chloro, zerenex e/9071908 PubChem CID: 89027 IUPAC Name: 2-bromo-5-chlorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)Br

Alfa Aesar™ 2,3,5-Triiodobenzoic acid, 98+%

CAS: 88-82-4 Molecular Formula: C7H3I3O2 Molecular Weight (g/mol): 499.812 MDL Number: MFCD00002420 InChI Key: ZMZGFLUUZLELNE-UHFFFAOYSA-N Synonym: floraltone, tiba, triiodobenzoic acid, johnkolor, benzoic acid, 2,3,5-triiodo, 2,3,5-tiba, caswell no. 890a, triiodobenzoic acid van, regin 8, kyselina 2,3,5-trijodbenzoova PubChem CID: 6948 ChEBI: CHEBI:73175 IUPAC Name: 2,3,5-triiodobenzoic acid SMILES: C1=C(C=C(C(=C1I)I)C(=O)O)I

Alfa Aesar™ 4-Ethoxycarbonyl-3-fluorobenzeneboronic acid, 95%

CAS: 874288-38-7 Molecular Formula: C9H10BFO4 Molecular Weight (g/mol): 211.983 MDL Number: MFCD06656274 InChI Key: CXSPPZZTTSHTMP-UHFFFAOYSA-N Synonym: 4-ethoxycarbonyl-3-fluorophenylboronic acid, 4-ethoxycarbonyl-3-fluorobenzeneboronic acid, ethyl 4-borono-2-fluorobenzoate, 4-ethoxycarbonyl-3-fluorophenyl boronic acid, 4-ethoxycarbonyl-3-fluoro-phenyl boronic acid, 4-ethoxycarbonyl-3-fluorophenylboronicacid, 3-fluoro-4-ethoxycarbonylphenylboronic acid, 4-borono-2-fluoro-benzoic acid, 1-ethyl ester, benzoic acid, 4-borono-2-fluoro-, 1-ethyl ester, acmc-209qm0 PubChem CID: 2763245 IUPAC Name: (4-ethoxycarbonyl-3-fluorophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)OCC)F)(O)O

Alfa Aesar™ 2-Bromo-6-chlorobenzoic acid, 98%

CAS: 93224-85-2 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00672929 InChI Key: URGXUQODOUMRFP-UHFFFAOYSA-N Synonym: 6-bromo-2-chlorobenzoic acid, 2-chloro-6-bromobenzoic acid, benzoic acid, 2-bromo-6-chloro, 2-bromo-6-chloro-benzoic acid, buttpark 51\01-28, akos msc-0781, 2-bromo-6-chlorobenzoicacid, pubchem4048, acmc-209rkm, 2-chloro-6-bromobenzoic PubChem CID: 33125 IUPAC Name: 2-bromo-6-chlorobenzoic acid SMILES: C1=CC(=C(C(=C1)Br)C(=O)O)Cl

Alfa Aesar™ 2-Bromo-5-methoxybenzamide, 98%

CAS: 99848-43-8 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.061 MDL Number: MFCD00208336 InChI Key: CMTKLJYDFPAPJS-UHFFFAOYSA-N Synonym: 29;bromo-5-methoxybenzamide PubChem CID: 2728705 IUPAC Name: 2-bromo-5-methoxybenzamide SMILES: COC1=CC(=C(C=C1)Br)C(=O)N

Alfa Aesar™ 4-Dimethylcarbamoyl-3-fluorobenzeneboronic acid, 98%

CAS: 874289-13-1 Molecular Formula: C9H11BFNO3 Molecular Weight (g/mol): 210.999 MDL Number: MFCD08436060 InChI Key: KEZPQOGKDGNRHH-UHFFFAOYSA-N Synonym: 4-dimethylcarbamoyl-3-fluorophenylboronic acid, 4-dimethylcarbamoyl-3-fluorophenyl boronic acid, 4-dimethylcarbamoyl-3-fluorobenzeneboronic acid, acmc-209qm6, 4-dimethylcarbamoyl-3-fluorophenyl boronicacid, 4-dimethyl carbamoyl-3-fluorophenylboronic acid, 4-dimethylcarbamoyl-3-fluoranyl-phenyl boronic acid, 4-dimethylamino oxo methyl-3-fluorophenyl boronic acid, boronic acid,b-4-dimethylamino carbonyl-3-fluorophenyl PubChem CID: 44717474 IUPAC Name: [4-(dimethylcarbamoyl)-3-fluorophenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)N(C)C)F)(O)O

Alfa Aesar™ 2-Bromo-6-methylbenzoic acid, 98%

CAS: 90259-31-7 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD01310788 InChI Key: ICXBPDJQFPIBSS-UHFFFAOYSA-N Synonym: 6-bromo-o-toluic acid, 2-bromo-6-methyl-benzoic acid, 6-bromo-2-methylbenzoic acid, benzoic acid, 2-bromo-6-methyl, bromtoluylsaure, bromotoluic acid, pubchem4715, acmc-209r5e, ksc494k9r, 3-bromo-2-carboxytoluene PubChem CID: 2735589 IUPAC Name: 2-bromo-6-methylbenzoic acid SMILES: CC1=C(C(=CC=C1)Br)C(=O)O

Alfa Aesar™ 2-Iodobenzoyl chloride, 98%

CAS: 609-67-6 Molecular Formula: C7H4ClIO Molecular Weight (g/mol): 266.462 MDL Number: MFCD00001040 InChI Key: MVIVDSWUOGNODP-UHFFFAOYSA-N Synonym: o-iodobenzoyl chloride, benzoyl chloride, 2-iodo, iodobenzoyl chloride, o-iodobenzoylchloride, 2-iodobezoyl chloride, o-iodo-benzoylchloride, 2-iodobenzoic chloride, 2-iodo-benzoyl chloride, acmc-1atjg, benzoyl chloride,2-iodo PubChem CID: 69112 IUPAC Name: 2-iodobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)I

Alfa Aesar™ 4-Fluoro-3-(4-fluorophenylcarbamoyl)benzeneboronic acid, 97%

CAS: 1449144-51-7 Molecular Formula: C13H10BF2NO3 Molecular Weight (g/mol): 277.034 MDL Number: MFCD20040220 InChI Key: KKBZXBGONBGNMX-UHFFFAOYSA-N Synonym: 4-fluoro-3-4-fluorophenylcarbamoyl benzeneboronic acid, 4-fluoro-3-4-fluorophenyl carbamoyl phenylboronic acid PubChem CID: 73995871 IUPAC Name: [4-fluoro-3-[(4-fluorophenyl)carbamoyl]phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)F)C(=O)NC2=CC=C(C=C2)F)(O)O

Alfa Aesar™ N-(2-Bromophenyl)-2,6-difluorobenzamide, 97%

CAS: 710291-06-8 Molecular Formula: C13H8BrF2NO Molecular Weight (g/mol): 312.114 MDL Number: MFCD03551394 InChI Key: UQJVZAKVKZRKMF-UHFFFAOYSA-N Synonym: n-2-bromophenyl-2,6-difluorobenzamide, 2,6-difluorophenyl-n-2-bromophenyl carboxamide PubChem CID: 4095566 IUPAC Name: N-(2-bromophenyl)-2,6-difluorobenzamide SMILES: C1=CC=C(C(=C1)NC(=O)C2=C(C=CC=C2F)F)Br

Alfa Aesar™ 2-Chloro-6-fluorobenzoyl chloride, 98%

CAS: 79455-63-3 Molecular Formula: C7H3Cl2FO Molecular Weight (g/mol): 192.998 MDL Number: MFCD00178746 InChI Key: GFNAJZAKJGKJCS-UHFFFAOYSA-N Synonym: 2-chloro-6-fluorobenzoylchloride, 2-chloro-6-fluorobenzene-1-carbonyl chloride, 2-chloro-6-fluoro-benzoyl chloride, 6-chloro-2-fluorobenzoyl chloride, benzoyl chloride, 2-chloro-6-fluoro, acmc-1behg, 2-fluoro-6-chlorobenzoyl chloride, attercop-chm at108371, 2-chloro-6-fluoro benzoyl chloride, 2-chloranyl-6-fluoranyl-benzoyl chloride PubChem CID: 2736547 IUPAC Name: 2-chloro-6-fluorobenzoyl chloride SMILES: C1=CC(=C(C(=C1)Cl)C(=O)Cl)F

Alfa Aesar™ Ethyl 2-bromobenzoate, 98+%

CAS: 6091-64-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00015443 InChI Key: BIHHBTVQFPVSTE-UHFFFAOYSA-N Synonym: 2-bromobenzoic acid ethyl ester, benzoic acid, 2-bromo-, ethyl ester, ethyl-2-bromobenzoate, ethyl2-bromobenzoate, ethyl bromobenzoate, ethyl o-bromobenzoate, pubchem3937, brombenzoesaureathylester, acmc-209mn8, ksc493o4r PubChem CID: 80186 IUPAC Name: ethyl 2-bromobenzoate SMILES: CCOC(=O)C1=CC=CC=C1Br

2-Bromo-5-fluorobenzoic acid, 99%, ACROS Organics™

CAS: 394-28-5 Molecular Formula: C7H4BrFO2 Molecular Weight (g/mol): 219.01 InChI Key: OQBMJMJZMDBQSM-UHFFFAOYSA-N Synonym: benzoic acid, 2-bromo-5-fluoro, 5-fluoro-2-bromobenzoic acid, 2-bromo-5-fluoro-benzoic acid, 2-bromo-5-fluorobenzoicacid, 2-bromo-5-fluorbenzoic acid, buttpark 19\01-66, pubchem1315, acmc-1ahhq, ksc226g3p, rarechem al bo 0747 PubChem CID: 2778181 IUPAC Name: 2-bromo-5-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)Br

Alfa Aesar™ 4-Chloro-3-(cyclopropylcarbamoyl)benzeneboronic acid, 98%

CAS: 871332-73-9 Molecular Formula: C10H11BClNO3 Molecular Weight (g/mol): 239.462 MDL Number: MFCD07783865 InChI Key: AZBIVGURALLESY-UHFFFAOYSA-N Synonym: 4-chloro-3-cyclopropylcarbamoyl phenylboronic acid, 4-chloro-3-cyclopropylcarbamoyl phenyl boronic acid, acmc-209qh3, n-cyclopropyl 5-borono-2-chlorobenzamide, n-cyclopropyl 2-chloro-5-boronobenzamide, 4-chloro-3-cyclopropylcarbamoyl benzeneboronic acid, boronic acid,b-4-chloro-3-cyclopropylamino carbonyl phenyl PubChem CID: 44886936 IUPAC Name: [4-chloro-3-(cyclopropylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)Cl)C(=O)NC2CC2)(O)O

2-Bromo-3-methylbenzoic acid, 97%, ACROS Organics™

CAS: 53663-39-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.04 MDL Number: MFCD00079721 InChI Key: LSRTWJCYIWGKCQ-UHFFFAOYSA-N Synonym: 2-bromo-3-methyl-benzoic acid, 2-bromo-m-toluic acid, 2-bromo-3-carboxytoluene, 2-bromo-3-methylbenzoicacid, 3-methyl-2-bromobenzoic acid, benzoic acid, bromo-3-methyl, 2-brom-3-methylbenzoic acid, pubchem3805, acmc-1ay3t, ksc497o4r PubChem CID: 2735588 IUPAC Name: 2-bromo-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1Br)C(=O)O

Alfa Aesar™ 3-Chloro-4-(dimethylcarbamoyl)benzeneboronic acid, 98%

CAS: 850589-47-8 Molecular Formula: C9H11BClNO3 Molecular Weight (g/mol): 227.451 MDL Number: MFCD07363772 InChI Key: FRYXYHGYFIBOQR-UHFFFAOYSA-N Synonym: 3-chloro-4-dimethylcarbamoyl phenyl boronic acid, 3-chloro-4-n,n-dimethylcarbamoyl phenylboronic acid, 3-chloro-4-dimethylcarbamoyl phenylboronic acid, 3-chloro-4-dimethylcarbamoyl benzeneboronic acid, 4-borono-2-chloro-n,n-dimethylbenzamide, 3-chloro-4-n,n-dimethylcarbamoyl benzeneboronic acid, 3-chloro-4-dimethylcarbamoyl phenyl boronicacid, 3-chloro-4-dimethyl-carbamoyl phenylboronic acid, 3-chloro-4-n,n-dimethyl carbamoyl phenylboronic acid PubChem CID: 44119415 IUPAC Name: [3-chloro-4-(dimethylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)N(C)C)Cl)(O)O

Alfa Aesar™ 2-Fluoro-4-methylbenzoyl chloride, 97%

CAS: 59189-98-9 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD04115879 InChI Key: SVSVOPWCUHQFAM-UHFFFAOYSA-N Synonym: benzoyl chloride, 2-fluoro-4-methyl-9ci, 2-fluoro-4-methyl-benzoyl chloride, benzoyl chloride, 2-fluoro-4-methyl PubChem CID: 5173367 IUPAC Name: 2-fluoro-4-methylbenzoyl chloride SMILES: CC1=CC(=C(C=C1)C(=O)Cl)F

Alfa Aesar™ 2-Chlorobenzamide, 98%

CAS: 609-66-5 Molecular Formula: C7H6ClNO Molecular Weight (g/mol): 155.581 MDL Number: MFCD00007973 InChI Key: RBGDLYUEXLWQBZ-UHFFFAOYSA-N Synonym: o-chlorobenzamide, benzamide, 2-chloro, benzamide, o-chloro, o-chloro-benzamide, unii-ke1m5i9i32, chlorobenzamide, pubchem3617, acmc-1aupu, 2-chlorobenzamide, dsstox_cid_30850 PubChem CID: 69111 IUPAC Name: 2-chlorobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)Cl

Alfa Aesar™ 2-Fluoro-4-(trifluoromethoxy)benzoyl chloride, 97%

CAS: 166948-50-1 Molecular Formula: C8H3ClF4O2 Molecular Weight (g/mol): 242.554 MDL Number: MFCD16652499 InChI Key: VDZYQIMWGWFOEH-UHFFFAOYSA-N Synonym: 2-fluoro-4-trifluoromethoxy benzoyl chloride PubChem CID: 66523483 IUPAC Name: 2-fluoro-4-(trifluoromethoxy)benzoyl chloride SMILES: C1=CC(=C(C=C1OC(F)(F)F)F)C(=O)Cl

2-Chlorobenzoyl chloride, 98%, ACROS Organics™

CAS: 609-65-4 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 InChI Key: ONIKNECPXCLUHT-UHFFFAOYSA-N Synonym: benzoyl chloride, 2-chloro, o-chlorobenzoyl chloride, chlorobenzoyl chloride, benzoyl chloride, o-chloro, ococ, 2-chloro-benzoyl chloride, unii-jr29a4n74x, o-chlorobenzoylchloride, 2-chlorobenzoylchloride, 2-chlorobenzoic acid chloride PubChem CID: 69110 ChEBI: CHEBI:60719 IUPAC Name: 2-chlorobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)Cl

Alfa Aesar™ 3-Carboxy-4-fluorobenzeneboronic acid, 97%

CAS: 872460-12-3 Molecular Formula: C7H6BFO4 Molecular Weight (g/mol): 183.929 MDL Number: MFCD03095129 InChI Key: DGORTXQWDDXSIQ-UHFFFAOYSA-N Synonym: 3-carboxy-4-fluorophenylboronic acid, 3-carboxy-4-fluorobenzeneboronic acid, 5-dihydroxyboranyl-2-fluorobenzoic acid, 4-fluoro-3-carboxyphenylboronic acid, benzoic acid, 5-borono-2-fluoro, 3-carboxyl-4-fluorophenylboronic acid, 5-borono-2-fluoro-benzoic acid, akos brn-0540, pubchem16787, acmc-209qj6 PubChem CID: 2763242 IUPAC Name: 5-borono-2-fluorobenzoic acid SMILES: B(C1=CC(=C(C=C1)F)C(=O)O)(O)O

Alfa Aesar™ Ethyl 2,6-dichlorobenzoate, 97%

CAS: 81055-73-4 Molecular Formula: C9H8Cl2O2 Molecular Weight (g/mol): 219.061 MDL Number: MFCD01313702 InChI Key: HAFAMHIZRCDTSS-UHFFFAOYSA-N Synonym: ethyl2,6-dichlorobenzoate, benzoicacid, 2,6-dichloro-, ethyl ester PubChem CID: 2737439 IUPAC Name: ethyl 2,6-dichlorobenzoate SMILES: CCOC(=O)C1=C(C=CC=C1Cl)Cl

Alfa Aesar™ 2-Chlorobenzhydrazide, 98+%

CAS: 5814-05-1 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.60 MDL Number: MFCD00007597 InChI Key: KPPNLSKVTKSSTG-UHFFFAOYSA-N Synonym: 2-chlorobenzhydrazide, 2-chlorobenzoic hydrazide, 2-chlorobenzoic acid hydrazide, 2-chlorobenzene-1-carbohydrazide, benzoylhydrazine, o-chloro, benzoic acid, 2-chloro-, hydrazide, 2-chlorobenzenecarbohydrazide, chlorobenzohydrazide, o-chlorobenzhydrazide, 2clphcon2 PubChem CID: 79883 IUPAC Name: 2-chlorobenzohydrazide SMILES: C1=CC=C(C(=C1)C(=O)NN)Cl

Ethyl 2-bromobenzoate, 98%, ACROS Organics™

CAS: 6091-64-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00015443 InChI Key: BIHHBTVQFPVSTE-UHFFFAOYSA-N Synonym: 2-bromobenzoic acid ethyl ester, benzoic acid, 2-bromo-, ethyl ester, ethyl-2-bromobenzoate, ethyl2-bromobenzoate, ethyl bromobenzoate, ethyl o-bromobenzoate, pubchem3937, brombenzoesaureathylester, acmc-209mn8, ksc493o4r PubChem CID: 80186 IUPAC Name: ethyl 2-bromobenzoate SMILES: CCOC(=O)C1=CC=CC=C1Br

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