Halobenzoic acids and derivatives

Pentafluorobenzoyl chloride, 98%, ACROS Organics™

CAS: 2251-50-5 Molecular Formula: C7ClF5O Molecular Weight (g/mol): 230.52 InChI Key: MYHOHFDYWMPGJY-UHFFFAOYSA-N Synonym: pentafluorobenzoyl chloride, perfluorobenzoyl chloride, benzoyl chloride, pentafluoro, pentafluorobenzoylchloride, pubchem15522, acmc-1covi, intermediates-zcf02601, pentafluorobenzoic acid chloride, attercop-chm at133861, 67924-15-6 unspecified acetate PubChem CID: 75256 ChEBI: CHEBI:39425 IUPAC Name: 2,3,4,5,6-pentafluorobenzoyl chloride SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)Cl

3-Chloroperoxybenzoic acid, 70-75%, balance 3-Chlorobenzoic acid and water, ACROS Organics™

CAS: 937-14-4 Molecular Formula: C7H5ClO3 Molecular Weight (g/mol): 172.57 MDL Number: MFCD00002127 InChI Key: NHQDETIJWKXCTC-UHFFFAOYSA-N Synonym: 3-chloroperoxybenzoic acid, 3-chloroperbenzoic acid, mcpba, m-chloroperbenzoic acid, m-chloroperoxybenzoic acid, meta-chloroperoxybenzoic acid, benzenecarboperoxoic acid, 3-chloro, m-chlorobenzoyl hydroperoxide, meta-chloroperbenzoic acid, 3-chlorobenzoperoxoic acid PubChem CID: 70297 ChEBI: CHEBI:52091 IUPAC Name: 3-chlorobenzenecarboperoxoic acid SMILES: C1=CC(=CC(=C1)Cl)C(=O)OO

Alfa Aesar™ 4-Chlorobenzoyl chloride, 98%

CAS: 122-01-0 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.008 MDL Number: MFCD00000686 InChI Key: RKIDDEGICSMIJA-UHFFFAOYSA-N Synonym: benzoyl chloride, 4-chloro, p-chlorobenzoyl chloride, para-chlorobenzoyl chloride, 4-chlorobenzoic acid chloride, 4-chlorobenzoylchloride, 4-chloro benzoyl chloride, benzoylchloride, 4-chloro, benzoyl chloride, p-chloro, ccris 8935, pcboc PubChem CID: 8501 ChEBI: CHEBI:60716 IUPAC Name: 4-chlorobenzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)Cl

Alfa Aesar™ Ethyl 4-fluorobenzoate, 99%

CAS: 451-46-7 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.167 MDL Number: MFCD00000351 InChI Key: UMPRJGKLMUDRHL-UHFFFAOYSA-N Synonym: 4-fluorobenzoic acid ethyl ester, ethyl p-fluorobenzoate, benzoic acid, 4-fluoro-, ethyl ester, p-fluorobenzoic acid, ethyl ester, ethyl4-fluorobenzoate, 4-fluoro-benzoic acid ethyl ester, benzoic acid, p-fluoro-, ethyl ester, ethyep-fluorobenzoate, pubchem3471, ethyl-4-fluorobenzoate PubChem CID: 67976 IUPAC Name: ethyl 4-fluorobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)F

Ethyl 4-iodobenzoate, 97%, ACROS Organics™

CAS: 51934-41-9 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.05 MDL Number: MFCD00017344 InChI Key: YCBJOQUNPLTBGG-UHFFFAOYSA-N Synonym: p-iodobenzoic acid ethyl ester, 4-iodobenzoic acid ethyl ester, ethyl p-iodobenzoate, ethyl-4-iodobenzoate, benzoicacid,4-iodo-,ethylester, 4-iodo-benzoic acid ethyl ester, benzoic acid, 4-iodo-, ethyl ester, ethyl4-iodobenzoate, ethyl-4 iodobenzoate, ethyl,4-iodobenzoate PubChem CID: 142891 IUPAC Name: ethyl 4-iodobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)I

2,6-Dichlorobenzoyl chloride, 99%, ACROS Organics™

CAS: 4659-45-4 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.46 MDL Number: MFCD00000662 InChI Key: JBLIDPPHFGWTKU-UHFFFAOYSA-N Synonym: benzoyl chloride, 2,6-dichloro, 2,6-dichlorobenzoylchloride, unii-394f6s81wy, 2,6-dichloro-benzoyl chloride, ccris 8617, pubchem18674, acmc-209k7i, 2.6-dichlorobenzoylchloride, dsstox_cid_12891, dsstox_rid_79043 PubChem CID: 78392 IUPAC Name: 2,6-dichlorobenzoyl chloride SMILES: C1=CC(=C(C(=C1)Cl)C(=O)Cl)Cl

Alfa Aesar™ 4-Bromophthalic acid, 98%

CAS: 6968-28-1 Molecular Formula: C8H5BrO4 Molecular Weight (g/mol): 245.028 MDL Number: MFCD00043538 InChI Key: AZXKGUVDIORSED-UHFFFAOYSA-N Synonym: 4-bromophthalicacid, 4-bromobenzene-1,2-dicarboxylic acid, 1,2-benzenedicarboxylic acid, 4-bromo, zlchem 539, 5-bromo-phthalic acid, acmc-209oah, #, 4-bromo-1,2-benzenedicarboxylic acid, 1,2-benzenedicarboxylicacid, 4-bromo, 4-bromobenzene-1,2-dioic acid PubChem CID: 81428 IUPAC Name: 4-bromophthalic acid SMILES: C1=CC(=C(C=C1Br)C(=O)O)C(=O)O

2-Chloro-6-fluorobenzene-1-carbonyl chloride, 97%, Maybridge™

CAS: 79455-63-3 Molecular Formula: C7H3Cl2FO Molecular Weight (g/mol): 192.998 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™ 3-Chloro-2,4,5,6-tetrafluorobenzoyl chloride, 98%

CAS: 292621-58-0 Molecular Formula: C7Cl2F4O Molecular Weight (g/mol): 246.97 MDL Number: MFCD03001175 InChI Key: GNXAQPALNSLOBK-UHFFFAOYSA-N Synonym: acmc-1cptj, 3-chloro-2,4,5,6-tetrafluorobenzoylchloride, benzoyl chloride,3-chloro-2,4,5,6-tetrafluoro, 3-chloranyl-2,4,5,6-tetrakis fluoranyl benzoyl chloride PubChem CID: 2783249 IUPAC Name: 3-chloro-2,4,5,6-tetrafluorobenzoyl chloride SMILES: C1(=C(C(=C(C(=C1F)Cl)F)F)F)C(=O)Cl

Alfa Aesar™ 2,4-Difluorobenzamide, 97%

CAS: 85118-02-1 Molecular Formula: C7H5F2NO Molecular Weight (g/mol): 157.12 MDL Number: MFCD00015547 InChI Key: KTXFXDMDYZIXSJ-UHFFFAOYSA-N Synonym: benzamide, 2,4-difluoro, difluoro benzamide, pubchem3458, acmc-209q4l, 2,4-difluorobenzamide, 2,4-bis fluoranyl benzamide PubChem CID: 123588 IUPAC Name: 2,4-difluorobenzamide SMILES: C1=CC(=C(C=C1F)F)C(=O)N

Alfa Aesar™ 3-Fluoro-4-methylbenzoic acid, 97%

CAS: 350-28-7 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00002490 InChI Key: XUQCONCMPCVUDM-UHFFFAOYSA-N Synonym: 3-fluoro-p-toluic acid, 3-fluoro-4-methylbenzoicacid, 3-fluoro-4-methyl-benzoic acid, benzoic acid, 3-fluoro-4-methyl, pubchem1330, acmc-209ich, 4-carboxy-2-fluorotoluene, 3-fluoro4-methylbenzoic acid, ksc223k8t, rarechem al bo 0761 PubChem CID: 67687 IUPAC Name: 3-fluoro-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)C(=O)O)F

Alfa Aesar™ 2-Fluoro-N-methylbenzamide, 97%

CAS: 52833-63-3 Molecular Formula: C8H8FNO Molecular Weight (g/mol): 153.156 MDL Number: MFCD01214098 InChI Key: NAGFMACWWJYORB-UHFFFAOYSA-N Synonym: o-fluoro-n-methylbenzamide, 2-fluoro-n-methyl-benzamide, benzamide,2-fluoro-n-methyl, benzamide, 2-fluoro-n-methyl, 2-fluorophenyl-n-methylcarboxamide PubChem CID: 2425972 IUPAC Name: 2-fluoro-N-methylbenzamide SMILES: CNC(=O)C1=CC=CC=C1F

Alfa Aesar™ 6-Chloro-2,3-difluorobenzamide, 97%

CAS: 1373920-98-9 Molecular Formula: C7H4ClF2NO Molecular Weight (g/mol): 191.562 MDL Number: MFCD22201031 InChI Key: RHWJPOYPLMCHEU-UHFFFAOYSA-N PubChem CID: 18471691 IUPAC Name: 6-chloro-2,3-difluorobenzamide SMILES: C1=CC(=C(C(=C1F)F)C(=O)N)Cl

Alfa Aesar™ 3-Bromo-2-methylbenzoic acid, 97%

CAS: 76006-33-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00270097 InChI Key: BJGKVCKGUBYULR-UHFFFAOYSA-N Synonym: 3-bromo-o-toluic acid, 2-methyl-3-bromobenzoic acid, 3-bromo-2-methyl-benzoic acid, benzoic acid, 3-bromo-2-methyl, pubchem4717, bromo-methylbenzoic acid, 2-bromo-6-carboxytoluene, 3-bromo-2-methybenzoic acid, 3-bromo-2-methylbenzoicacid, ksc377a4p PubChem CID: 2735590 IUPAC Name: 3-bromo-2-methylbenzoic acid SMILES: CC1=C(C=CC=C1Br)C(=O)O

Alfa Aesar™ 3-Chloro-2,4-difluorobenzoic acid, 97%

CAS: 154257-75-7 Molecular Formula: C7H3ClF2O2 Molecular Weight (g/mol): 192.546 MDL Number: MFCD01631387 InChI Key: YGYZTZAEZMCPSC-UHFFFAOYSA-N Synonym: 3-chloro-2,4-difluoro-benzoic acid, 2,4-difluoro-3-chlorobenzoic acid, 3-chloro-2,4-difluorobenzoicacid, benzoic acid, 3-chloro-2,4-difluoro, pubchem2217, acmc-1byme, intermediates-zcf02173, ksc181k3p PubChem CID: 2773532 IUPAC Name: 3-chloro-2,4-difluorobenzoic acid SMILES: C1=CC(=C(C(=C1C(=O)O)F)Cl)F

Alfa Aesar™ 2-Chlorobenzoic acid, 98+%

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

Alfa Aesar™ 5-(2-Chloro-6-nitrophenylcarbamoyl)-3-fluorobenzeneboronic acid, 97%

CAS: 1449133-18-9 Molecular Formula: C13H9BClFN2O5 Molecular Weight (g/mol): 338.482 MDL Number: MFCD20126195 InChI Key: SMRJKQIAHFDGKT-UHFFFAOYSA-N Synonym: 5-2-chloro-6-nitrophenylcarbamoyl-3-fluorobenzeneboronic acid, 3-2-chloro-6-nitrophenyl carbamoyl-5-fluorophenylboronic acid PubChem CID: 73995623 IUPAC Name: [3-[(2-chloro-6-nitrophenyl)carbamoyl]-5-fluorophenyl]boronic acid SMILES: B(C1=CC(=CC(=C1)F)C(=O)NC2=C(C=CC=C2Cl)[N+](=O)[O-])(O)O

Alfa Aesar™ Ethyl pentafluorobenzoate, 98%

CAS: 4522-93-4 Molecular Formula: C9H5F5O2 Molecular Weight (g/mol): 240.129 MDL Number: MFCD00039211 InChI Key: DFUDMSIRGGTHGI-UHFFFAOYSA-N Synonym: ethyl pentafluorobenzoate, ethyl perfluorobenzoate, pentafluorobenzoic acid ethyl ester, 2,3,4,5,6-pentafluoro-benzoic acid ethyl ester, benzoic acid, pentafluoro-, ethyl ester, ethylpentafluorobenzoate, acmc-1ajj1, rarechem al bi 0017, perfluorobenzoic acid ethyl ester PubChem CID: 78283 IUPAC Name: ethyl 2,3,4,5,6-pentafluorobenzoate SMILES: CCOC(=O)C1=C(C(=C(C(=C1F)F)F)F)F

3,5-Dibromobenzoic acid, 99%, ACROS Organics™

CAS: 618-58-6 Molecular Formula: C7H4Br2O2 Molecular Weight (g/mol): 279.91 InChI Key: SFTFNJZWZHASAQ-UHFFFAOYSA-N Synonym: benzoic acid, 3,5-dibromo, 3,5-dibromobenzoicacid, benzoicacid, 3,5-dibromo, buttpark 99\57-19, pubchem3861, acmc-209mwz, maybridge1_003318, 3,5-dibromo-benzoic acid, 4-09-00-01028 beilstein handbook reference, ksc358a3h PubChem CID: 12063 IUPAC Name: 3,5-dibromobenzoic acid SMILES: C1=C(C=C(C=C1Br)Br)C(=O)O

Alfa Aesar™ Methyl 2,6-difluorobenzoate, 97%

CAS: 13671-00-6 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD00051778 InChI Key: QNPFLTKQLFSKBY-UHFFFAOYSA-N Synonym: 2,6-difluorobenzoic acid, methyl ester, benzoic acid, 2,6-difluoro-, methyl ester, acmc-1bxyv, ksc494g7r, methyl2,6-difluorobenzoate, methyl 2,6-difluorobenzoate, 2,6-difluorobenzoic acid methyl ester, 2-methoxycarbonyl-1,3-difluorobenzene PubChem CID: 518798 IUPAC Name: methyl 2,6-difluorobenzoate SMILES: COC(=O)C1=C(C=CC=C1F)F

Alfa Aesar™ 4-Bromo-3-methylbenzoic acid, 98%

CAS: 7697-28-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00039526 InChI Key: KWVXDZLVCISXIB-UHFFFAOYSA-N Synonym: 4-bromo-m-toluic acid, 4-bromo-3-methyl-benzoic acid, 4-bromo-3-methylbenzoicacid, 3-methyl-4-bromobenzoic acid, 4-bromo-3-methyl benzoic acid, benzoic acid, 4-bromo-3-methyl, pubchem3807, 4bromo-3-methylbenzoic acid, 4-bromo-5-methylbenzoic acid, ksc379g0b PubChem CID: 82131 IUPAC Name: 4-bromo-3-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)C(=O)O)Br

Alfa Aesar™ N-(2-Chloro-4-iodophenyl)-2-fluorobenzamide, 97%

CAS: 433316-37-1 Molecular Formula: C13H8ClFINO Molecular Weight (g/mol): 375.566 MDL Number: MFCD03240789 InChI Key: HMFPZLBLOKLAPU-UHFFFAOYSA-N Synonym: n-2-chloro-4-iodophenyl-2-fluorobenzamide, cambridge id 6920372 PubChem CID: 1324056 IUPAC Name: N-(2-chloro-4-iodophenyl)-2-fluorobenzamide SMILES: C1=CC=C(C(=C1)C(=O)NC2=C(C=C(C=C2)I)Cl)F

Alfa Aesar™ 2,5-Difluorobenzoyl chloride, 98%

CAS: 35730-09-7 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.547 MDL Number: MFCD00009929 InChI Key: RLRUKKDFNWXXRT-UHFFFAOYSA-N Synonym: 2,5-difluorobenzoylchloride, benzoyl chloride, 2,5-difluoro, benzoyl chloride,2,5-difluoro, acmc-1afez, 2,5-difluoro benzoyl chloride, 2,5-difluoro-benzoyl chloride, 2,5-difluorobenzoyl chloride PubChem CID: 588082 IUPAC Name: 2,5-difluorobenzoyl chloride SMILES: C1=CC(=C(C=C1F)C(=O)Cl)F

Alfa Aesar™ Methyl 3,5-dichlorobenzoate, 98%

CAS: 2905-67-1 Molecular Formula: C8H6Cl2O2 Molecular Weight (g/mol): 205.034 MDL Number: MFCD00032710 InChI Key: BTEVDFJXGLQUDS-UHFFFAOYSA-N Synonym: 3,5-dichlorobenzoic acid methyl ester, benzoic acid, 3,5-dichloro-, methyl ester, unii-4gim06ee3p, 4gim06ee3p, methyl-3,5-dichlorobenzoate, maybridge1_004559, acmc-1cd9x, dsstox_cid_22146, dsstox_rid_79937, dsstox_gsid_42146 PubChem CID: 76192 IUPAC Name: methyl 3,5-dichlorobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)Cl)Cl

4-Chlorobenzoyl chloride, 99+%, ACROS Organics™

CAS: 122-01-0 Molecular Formula: C7H4Cl2O Molecular Weight (g/mol): 175.01 InChI Key: RKIDDEGICSMIJA-UHFFFAOYSA-N Synonym: benzoyl chloride, 4-chloro, p-chlorobenzoyl chloride, para-chlorobenzoyl chloride, 4-chlorobenzoic acid chloride, 4-chlorobenzoylchloride, 4-chloro benzoyl chloride, benzoylchloride, 4-chloro, benzoyl chloride, p-chloro, ccris 8935, pcboc PubChem CID: 8501 ChEBI: CHEBI:60716 IUPAC Name: 4-chlorobenzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)Cl

Alfa Aesar™ 2-Chloro-4-(methylsulfonyl)benzoic acid, 96%

CAS: 53250-83-2 Molecular Formula: C8H7ClO4S Molecular Weight (g/mol): 234.65 MDL Number: MFCD00216496 InChI Key: CTTWSFIIFMWHLQ-UHFFFAOYSA-N Synonym: 2-chloro-4-methylsulfonyl benzoic acid, 2-chloro-4-methylsulphonylbenzoic acid, 2-chloro-4-methanesulfonylbenzoic acid, benzoic acid, 2-chloro-4-methylsulfonyl, 2-chloro-4-methanesulfonyl-benzoic acid, 2-chloro-4-methylsulfonyl benzoic acid dry basis, maybridge1_004133, cmba, pubchem20281, acmc-1aupa PubChem CID: 735863 IUPAC Name: 2-chloro-4-methylsulfonylbenzoic acid SMILES: CS(=O)(=O)C1=CC(=C(C=C1)C(=O)O)Cl

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

CAS: 124700-41-0 Molecular Formula: C7H4FIO2 Molecular Weight (g/mol): 266.01 MDL Number: MFCD03094517 InChI Key: QNNJHBNTHVHALE-UHFFFAOYSA-N Synonym: benzoic acid, 2-fluoro-5-iodo, 2-fluoro-5-iodobenzoicacid, 2-fluoro-5-iodo-benzoic acid, pubchem1385, acmc-1c24w, ksc174o6d, rarechem al bo 1479, buttpark 122\01-06, 5-iodo-2-fluorobenzoic acid, 2-fluoro-5-iodobenzoic acid PubChem CID: 2778925 IUPAC Name: 2-fluoro-5-iodobenzoic acid SMILES: C1=CC(=C(C=C1I)C(=O)O)F

Alfa Aesar™ 2-Fluoro-6-methoxybenzamide, 98%

CAS: 529512-81-0 Molecular Formula: C8H8FNO2 Molecular Weight (g/mol): 169.155 MDL Number: MFCD00277474 InChI Key: BDJNFURQDZEPLK-UHFFFAOYSA-N Synonym: 2-fluoro-6-methoxy-benzamide, 2-methoxy-6-fluorobenzamide, 2-fluoro-6-methoxy benzamide, #, benzamide, 2-fluoro-6-methoxy PubChem CID: 579738 IUPAC Name: 2-fluoro-6-methoxybenzamide SMILES: COC1=C(C(=CC=C1)F)C(=O)N

Alfa Aesar™ 3-Fluoro-5-(trifluoromethoxy)benzoic acid, 97%

CAS: 1242258-49-6 Molecular Formula: C8H4F4O3 Molecular Weight (g/mol): 224.111 MDL Number: MFCD18783221 InChI Key: RPEBABGCYLHTAK-UHFFFAOYSA-N Synonym: 3-fluoro-5-trifluoromethoxy benzoic acid PubChem CID: 66523531 IUPAC Name: 3-fluoro-5-(trifluoromethoxy)benzoic acid SMILES: C1=C(C=C(C=C1OC(F)(F)F)F)C(=O)O

Alfa Aesar™ 4-Fluorophthalic acid, 98%

CAS: 320-97-8 Molecular Formula: C8H5FO4 Molecular Weight (g/mol): 184.122 MDL Number: MFCD06208213 InChI Key: OMCXTFVBNCFZMY-UHFFFAOYSA-N Synonym: 4-fluorobenzene-1,2-dicarboxylic acid, 1,2-benzenedicarboxylic acid, 4-fluoro, 5-fluorophtalic acid, 5-fluorophthalic acid, 4-fluorobenzene-1,2-dioic acid, 3-fluorophthalicacid, pubchem1406, rarechem al bo 0829, 1,2-benzenedicarboxylicacid, 4-fluoro PubChem CID: 15312 IUPAC Name: 4-fluorophthalic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)C(=O)O

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