2-halobenzoic acids and derivatives

2-Chlorobenzoic acid, 98%, Acros Organics

CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: 2-cba PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl

Alfa Aesar™ 2-Chlorobenzoyl chloride, 97%

CAS: 609-65-4 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 MDL Number: MFCD00000660 InChI Key: ONIKNECPXCLUHT-UHFFFAOYSA-N Synonym: 2-chloro-benzoyl chloride PubChem CID: 69110 ChEBI: CHEBI:60719 IUPAC Name: 2-chlorobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)Cl

Alfa Aesar™ 2-Fluorobenzoic acid, 98+%

CAS: 445-29-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002405 InChI Key: NSTREUWFTAOOKS-UHFFFAOYSA-N Synonym: 2-fluoro-benzoic acid PubChem CID: 9935 ChEBI: CHEBI:19577 IUPAC Name: 2-fluorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)F

Alfa Aesar™ 2,6-Difluorobenzoic acid, 98+%

CAS: 385-00-2 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.104 MDL Number: MFCD00002411 InChI Key: ONOTYLMNTZNAQZ-UHFFFAOYSA-N Synonym: 2,6,-difluorobenzoic acid PubChem CID: 9796 IUPAC Name: 2,6-difluorobenzoic acid SMILES: C1=CC(=C(C(=C1)F)C(=O)O)F

Alfa Aesar™ 2-Chloro-N-(2,5-dimethoxyphenyl)benzamide, 97%

CAS: 196938-30-4 Molecular Formula: C15H14ClNO3 Molecular Weight (g/mol): 291.731 MDL Number: MFCD00095371 InChI Key: RLHACPNMKPCNMS-UHFFFAOYSA-N Synonym: 2-chloro-2',5'-dimethoxybenzanilide PubChem CID: 307419 IUPAC Name: 2-chloro-N-(2,5-dimethoxyphenyl)benzamide SMILES: COC1=CC(=C(C=C1)OC)NC(=O)C2=CC=CC=C2Cl

Methyl 2-Fluorobenzoate 98.0+%, TCI America™

CAS: 394-35-4 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00017913 InChI Key: QAFJIJWLEBLXHH-UHFFFAOYSA-N Synonym: 2-fluoro-benzoic acid methyl ester PubChem CID: 67854 IUPAC Name: methyl 2-fluorobenzoate SMILES: COC(=O)C1=CC=CC=C1F

Alfa Aesar™ 2-Chloro-5-iodobenzoic acid, 97%

CAS: 19094-56-5 Molecular Formula: C7H4ClIO2 Molecular Weight (g/mol): 282.461 MDL Number: MFCD00079731 InChI Key: GEBYSTBEDVQOTK-UHFFFAOYSA-N Synonym: 2-chloro-5-iodo-benzoic acid PubChem CID: 519638 IUPAC Name: 2-chloro-5-iodobenzoic acid SMILES: C1=CC(=C(C=C1I)C(=O)O)Cl

2-Fluoro-4-methylbenzoic Acid 98.0+%, TCI America™

CAS: 7697-23-6 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD03092906 InChI Key: ALFWHEYHCZRVLO-UHFFFAOYSA-N Synonym: 2-fluoro-4-methyl benzoic acid PubChem CID: 2736145 IUPAC Name: 2-fluoro-4-methylbenzoic acid SMILES: CC1=CC(=C(C=C1)C(=O)O)F

Alfa Aesar™ 2,6-Difluoro-3-methylbenzoic acid, 97+%

CAS: 32890-88-3 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD01631332 InChI Key: QZIVNVIPFGKDQE-UHFFFAOYSA-N Synonym: 2,6-difluoro-3-methyl-benzoic acid PubChem CID: 2774142 IUPAC Name: 2,6-difluoro-3-methylbenzoic acid SMILES: CC1=C(C(=C(C=C1)F)C(=O)O)F

2,3,5-Trifluorobenzoic Acid 98.0+%, TCI America™

CAS: 654-87-5 Molecular Formula: C7H3F3O2 Molecular Weight (g/mol): 176.094 MDL Number: MFCD00061200 InChI Key: CPZROMDDCPPFOO-UHFFFAOYSA-N Synonym: 2,3,5-trifluoro-benzoic acid PubChem CID: 2776991 IUPAC Name: 2,3,5-trifluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)F)C(=O)O)F

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 benzeneboronic acid 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

Alfa Aesar™ 5-Chloro-2-fluorobenzoic acid, 97%

CAS: 394-30-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.555 MDL Number: MFCD00665762 InChI Key: WGAVMKXCDMQVNF-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzoic acid PubChem CID: 2736537 IUPAC Name: 5-chloro-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)C(=O)O)F

Alfa Aesar™ Methyl 2-fluoro-6-methoxybenzoate, 98%

CAS: 178747-79-0 Molecular Formula: C9H9FO3 Molecular Weight (g/mol): 184.166 MDL Number: MFCD03788537 InChI Key: WOKPPDUGASITJX-UHFFFAOYSA-N Synonym: 2-fluoro-6-methoxy-benzoic acid methyl ester PubChem CID: 2779314 IUPAC Name: methyl 2-fluoro-6-methoxybenzoate SMILES: COC1=C(C(=CC=C1)F)C(=O)OC

2-Iodobenzoic Acid 98.0+%, TCI America™

CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.019 MDL Number: MFCD00002419 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: 2-iodo benzoic acid PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I

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

CAS: 120153-08-4 Molecular Formula: C7H6BFO4 Molecular Weight (g/mol): 183.929 MDL Number: MFCD01114671 InChI Key: CZDWJVSOQOMYGC-UHFFFAOYSA-N Synonym: 3-fluoro-4-carboxy-phenylboronic acid PubChem CID: 2763201 IUPAC Name: 4-borono-2-fluorobenzoic acid SMILES: B(C1=CC(=C(C=C1)C(=O)O)F)(O)O

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: 3-fluoro-4-ethoxycarbonylphenylboronic acid PubChem CID: 2763245 IUPAC Name: (4-ethoxycarbonyl-3-fluorophenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)OCC)F)(O)O

2-Chlorobenzoic Acid 98.0+%, TCI America™

CAS: 118-91-2 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002412 InChI Key: IKCLCGXPQILATA-UHFFFAOYSA-N Synonym: 2-cba PubChem CID: 8374 ChEBI: CHEBI:30793 IUPAC Name: 2-chlorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)Cl

2-Fluorobenzohydrazide 98.0+%, TCI America™

CAS: 446-24-2 Molecular Formula: C7H7FN2O Molecular Weight (g/mol): 154.144 MDL Number: MFCD00025112 InChI Key: YJCCKQQVXNNAAR-UHFFFAOYSA-N Synonym: 2-fluoranylbenzohydrazide PubChem CID: 136288 IUPAC Name: 2-fluorobenzohydrazide SMILES: C1=CC=C(C(=C1)C(=O)NN)F

Alfa Aesar™ 2-Chloro-5-fluoro-3-methylbenzoic acid, 98%

CAS: 1427416-28-1 Molecular Formula: C8H6ClFO2 Molecular Weight (g/mol): 188.582 MDL Number: MFCD23712098 InChI Key: AILHHXAQZADVIH-UHFFFAOYSA-N Synonym: 2-chloro-5-fluoro-3-methylbenzoicacid PubChem CID: 53430534 IUPAC Name: 2-chloro-5-fluoro-3-methylbenzoic acid SMILES: CC1=C(C(=CC(=C1)F)C(=O)O)Cl

4-Fluoro-3-methoxycarbonylphenylboronic acid, 98%, Acros Organics™

CAS: 874219-35-9 Molecular Formula: C8H8BFO4 Molecular Weight (g/mol): 197.96 InChI Key: GQBWFAIHGHHNMM-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl-4-fluorophenylboronic acid PubChem CID: 23005332 IUPAC Name: (4-fluoro-3-methoxycarbonylphenyl)boronic acid SMILES: B(C1=CC(=C(C=C1)F)C(=O)OC)(O)O

Alfa Aesar™ 2,6-Difluorobenzamide, 98+%

CAS: 18063-03-1 Molecular Formula: C7H5F2NO Molecular Weight (g/mol): 157.12 MDL Number: MFCD00007972 InChI Key: AVRQBXVUUXHRMY-UHFFFAOYSA-N Synonym: 2, 6 difluorobenzamide PubChem CID: 87439 IUPAC Name: 2,6-difluorobenzamide SMILES: C1=CC(=C(C(=C1)F)C(=O)N)F

2-Iodobenzoic acid, 98%, ACROS Organics™

CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.01 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: 2-iodo benzoic acid PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I

Alfa Aesar™ N-Benzyl-2-chloro-N-phenylbenzamide, 97%

CAS: 500873-57-4 Molecular Formula: C20H16ClNO Molecular Weight (g/mol): 321.804 MDL Number: MFCD03731396 InChI Key: OWBLYVPLNRYXED-UHFFFAOYSA-N PubChem CID: 295307 IUPAC Name: N-benzyl-2-chloro-N-phenylbenzamide SMILES: C1=CC=C(C=C1)CN(C2=CC=CC=C2)C(=O)C3=CC=CC=C3Cl

2-Bromo-5-fluorobenzoic Acid 98.0+%, TCI America™

CAS: 394-28-5 Molecular Formula: C7H4BrFO2 Molecular Weight (g/mol): 219.009 InChI Key: OQBMJMJZMDBQSM-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorbenzoic acid PubChem CID: 2778181 IUPAC Name: 2-bromo-5-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)Br

5-Bromo-2-chlorobenzoic Acid 98.0+%, TCI America™

CAS: 21739-92-4 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00002415 InChI Key: FGERXQWKKIVFQG-UHFFFAOYSA-N Synonym: 2-chloro-5-bromobenzoic acid PubChem CID: 33127 IUPAC Name: 5-bromo-2-chlorobenzoic acid SMILES: C1=CC(=C(C=C1Br)C(=O)O)Cl

Alfa Aesar™ 4-Ethoxy-2-fluorobenzoic acid, 97%

CAS: 1206593-29-4 Molecular Formula: C9H9FO3 Molecular Weight (g/mol): 184.166 MDL Number: MFCD13196593 InChI Key: WVXNAAKJFTYOCN-UHFFFAOYSA-N PubChem CID: 19978989 IUPAC Name: 4-ethoxy-2-fluorobenzoic acid SMILES: CCOC1=CC(=C(C=C1)C(=O)O)F

Alfa Aesar™ Ethyl 2-chlorobenzoate, 98%

CAS: 7335-25-3 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00016338 InChI Key: RETLCWPMLJPOTP-UHFFFAOYSA-N Synonym: 2-chlorobenzoic acid ethyl ester PubChem CID: 81783 IUPAC Name: ethyl 2-chlorobenzoate SMILES: CCOC(=O)C1=CC=CC=C1Cl

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

CAS: 850589-49-0 Molecular Formula: C11H13BClNO4 Molecular Weight (g/mol): 269.488 MDL Number: MFCD07363774 InChI Key: HPRBSCDTOODIQX-UHFFFAOYSA-N Synonym: 3-chloro-4-4-morpholinylcarbonyl benzeneboronic acid PubChem CID: 44119419 IUPAC Name: [3-chloro-4-(morpholine-4-carbonyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)C(=O)N2CCOCC2)Cl)(O)O

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

CAS: 871332-71-7 Molecular Formula: C11H13BClNO4 Molecular Weight (g/mol): 269.488 MDL Number: MFCD07783863 InChI Key: SWIHOHJBUZBINE-UHFFFAOYSA-N Synonym: 4-chloro-3-4-morpholinylcarbonyl benzeneboronic acid PubChem CID: 44886934 IUPAC Name: [4-chloro-3-(morpholine-4-carbonyl)phenyl]boronic acid SMILES: B(C1=CC(=C(C=C1)Cl)C(=O)N2CCOCC2)(O)O

Alfa Aesar™ 2-Chloro-5-nitrobenzoyl chloride, 96%

CAS: 25784-91-2 Molecular Formula: C7H3Cl2NO3 Molecular Weight (g/mol): 220.005 MDL Number: MFCD00059180 InChI Key: OGLKKYALUKXVPQ-UHFFFAOYSA-N Synonym: 2-chloranyl-5-nitro-benzoyl chloride PubChem CID: 117637 IUPAC Name: 2-chloro-5-nitrobenzoyl chloride SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl

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