4-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

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

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

Alfa Aesar™ N-tert-Butyl-4-fluorobenzamide, 97%

CAS: 49834-29-9 Molecular Formula: C11H14FNO Molecular Weight (g/mol): 195.237 MDL Number: MFCD00463095 InChI Key: ZMYTVKMZSNODPU-UHFFFAOYSA-N Synonym: n-t-butyl-4-fluorobenzamide, n-tert-butyl-4-fluorobenzamide, n-tert-butyl-4-fluoro-benzamide, acmc-209kih PubChem CID: 4295826 IUPAC Name: N-tert-butyl-4-fluorobenzamide SMILES: CC(C)(C)NC(=O)C1=CC=C(C=C1)F

Alfa Aesar™ Methyl 4-chloro-3-methylbenzoate, 97%

CAS: 91367-05-4 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00151838 InChI Key: QOTGNXMPQNGYDM-UHFFFAOYSA-N Synonym: 4-chloro-3-methylbenzoic acid methyl ester, benzoic acid, 4-chloro-3-methyl-, methyl ester, pubchem3710, acmc-209r8w, 2-chloro-5-methoxycarbonyl toluene, methyl 4-chloranyl-3-methyl-benzoate, 4-chloro-m-toluic acid methyl ester, 4-chloro-3-methylbenzoic acid, methyl ester PubChem CID: 7015786 IUPAC Name: methyl 4-chloro-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)Cl

Alfa Aesar™ Ethyl 4-iodobenzoate, 98%

CAS: 51934-41-9 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 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

Alfa Aesar™ 4-Chloro-N-(4-methoxyphenyl)benzamide, 97%

CAS: 4018-82-0 Molecular Formula: C14H12ClNO2 Molecular Weight (g/mol): 261.705 MDL Number: MFCD00508611 InChI Key: UVGPQLMHIRNFEE-UHFFFAOYSA-N Synonym: 4-chloro-n-4-methoxyphenyl benzamide, n-p-chlorobenzoyl-p-anisidine, 4-chloro-n-4-methoxy-phenyl-benzamide, benzamide, 4-chloro-n-4-methoxyphenyl, cambridge id 5190257, n-4-methoxyphenyl-4-chlorobenzamide, 4-chloro-n-4-methoxyphenyl-benzamide, 4-chloro-n-4-methoxyphenyl benzamide #, 4-chlorobenzenamide, n-4-methoxyphenyl PubChem CID: 221848 IUPAC Name: 4-chloro-N-(4-methoxyphenyl)benzamide SMILES: COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)Cl

Alfa Aesar™ 4-Fluoro-N-phenylbenzamide, 97%

CAS: 366-63-2 Molecular Formula: C13H10FNO Molecular Weight (g/mol): 215.227 MDL Number: MFCD00055240 InChI Key: FIEGRQABVBXYQT-UHFFFAOYSA-N Synonym: 4-fluorobenzanilide, 4-fluoro-n-phenyl-benzamide, n-phenyl-4-fluorobenzamide, 4-fluorophenyl-n-benzamide, 4-fluoro-n~1~-phenylbenzamide, fiegrqabvbxyqt-uhfffaoysa PubChem CID: 96095 IUPAC Name: 4-fluoro-N-phenylbenzamide SMILES: C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)F

Alfa Aesar™ 4-Chloro-2-fluorobenzoic acid, 98%

CAS: 446-30-0 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.555 MDL Number: MFCD00042468 InChI Key: ZLPXBWMVZANJJQ-UHFFFAOYSA-N Synonym: 2-fluoro-4-chlorobenzoic acid, benzoic acid, 4-chloro-2-fluoro, 4-chloro-2-fluorobenzoicacid, 4-chloro-2-fluoro-benzoic acid, pubchem1374, acmc-209jz4, ksc237m4j, rarechem al bo 0755, 4-chloro-2-fluoro benzoic acid, timtec-bb sbb003797 PubChem CID: 99152 IUPAC Name: 4-chloro-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)F)C(=O)O

Alfa Aesar™ 2-Chloro-4-fluorobenzoyl chloride, 97%

CAS: 21900-54-9 Molecular Formula: C7H3Cl2FO Molecular Weight (g/mol): 192.998 MDL Number: MFCD00084954 InChI Key: POIAZJJVWRVLBO-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobenzoylchloride, 2-chloro-4-fluoro-benzoyl chloride, 2-chloro-4-fluorobenzene-1-carbonyl chloride, benzoyl chloride, 2-chloro-4-fluoro, benzoyl chloride,2-chloro-4-fluoro, acmc-20anzq, ksc547s3d, 2-chlor-4-fluorbenzoylchlorid, 2chloro-4-fluorobenzoyl chloride, 4-fluoro-2-chlorobenzoyl chloride PubChem CID: 2736546 IUPAC Name: 2-chloro-4-fluorobenzoyl chloride SMILES: C1=CC(=C(C=C1F)Cl)C(=O)Cl

Alfa Aesar™ 4-Chloro-2,3,5,6-tetrafluorobenzoyl chloride, 98%

CAS: 145572-10-7 Molecular Formula: C7Cl2F4O Molecular Weight (g/mol): 246.97 MDL Number: MFCD03001172 InChI Key: BCYRJFXGRNBBAF-UHFFFAOYSA-N Synonym: benzoyl chloride,4-chloro-2,3,5,6-tetrafluoro, acmc-1c6jt, 4-chloro-2,3,5,6-tetrafluorobenzoylchloride, 4-chlorotetrafluorobenzoyl chloride, 4-chloranyl-2,3,5,6-tetrakis fluoranyl benzoyl chloride PubChem CID: 2783250 IUPAC Name: 4-chloro-2,3,5,6-tetrafluorobenzoyl chloride SMILES: C1(=C(C(=C(C(=C1F)F)Cl)F)F)C(=O)Cl

Pentafluorobenzoic acid, 99%, Acros Organics™

CAS: 602-94-8 Molecular Formula: C7HF5O2 Molecular Weight (g/mol): 212.07 InChI Key: YZERDTREOUSUHF-UHFFFAOYSA-N Synonym: pentafluorobenzoic acid, perfluorobenzoic acid, benzoic acid, pentafluoro, benzoic acid, 2,3,4,5,6-pentafluoro, 2,3,4,5,6-pentafluorobenzoicacid, pubchem2320, acmc-1b1wz, 4-09-00-00956 beilstein handbook reference, ksc355e3b, rarechem al bo 0017 PubChem CID: 11770 ChEBI: CHEBI:46796 IUPAC Name: 2,3,4,5,6-pentafluorobenzoic acid SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)C(=O)O

Alfa Aesar™ 4-Bromo-3,5-dihydroxybenzamide, 97%

CAS: 13429-12-4 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.03 MDL Number: MFCD00017131 InChI Key: GCNIEGHLVCGBRA-UHFFFAOYSA-N Synonym: 4-bromo-3,5-resorcylamide, benzamide, 4-bromo-3,5-dihydroxy, .alpha.-resorcylamide, 4-bromo, acmc-1bzb8, benzamide,4-bromo-3,5-dihydroxy, 4-bromanyl-3,5-bis oxidanyl benzamide, alpha-resorcylamide, 4-bromo-8ci PubChem CID: 83438 IUPAC Name: 4-bromo-3,5-dihydroxybenzamide SMILES: C1=C(C=C(C(=C1O)Br)O)C(=O)N

Alfa Aesar™ 3-Chloro-4-fluorobenzoyl chloride, 97%

CAS: 65055-17-6 Molecular Formula: C7H3Cl2FO Molecular Weight (g/mol): 192.998 MDL Number: MFCD00236215 InChI Key: DLZUHSFUBZTBQZ-UHFFFAOYSA-N Synonym: 4-fluoro-3-chlorobenzoyl chloride, 3-chloro-4-fluorobenzoylchloride, 3-chloro-4-fluoro benzoyl chloride, 3-chloro-4-fluoro-benzoyl chloride, benzoyl chloride, 3-chloro-4-fluoro, acmc-209np6, dsstox_cid_29301, dsstox_rid_83419, dsstox_gsid_49344, ksc622a8f PubChem CID: 2736548 IUPAC Name: 3-chloro-4-fluorobenzoyl chloride SMILES: C1=CC(=C(C=C1C(=O)Cl)Cl)F

Alfa Aesar™ 4-Chloro-N-ethylbenzamide, 97%

CAS: 26930-17-6 Molecular Formula: C9H10ClNO Molecular Weight (g/mol): 183.635 MDL Number: MFCD00871156 InChI Key: TXRYLYLDCHDRSJ-UHFFFAOYSA-N Synonym: benzamide, 4-chloro-n-ethyl, 4-chloro-n-ethyl-benzamide, n-ethyl-4-chlorobenzamide, 4-chlorobenzamide, n-ethyl, benzamide, p-chloro-n-ethyl, 4-chloro-n-ethylbenzenecarboxamide, 4-chlorophenyl-n-ethylcarboxamide PubChem CID: 101292 IUPAC Name: 4-chloro-N-ethylbenzamide SMILES: CCNC(=O)C1=CC=C(C=C1)Cl

Alfa Aesar™ 3-Ethoxy-2,4-difluorobenzamide, 97%

CAS: 1017779-91-7 Molecular Formula: C9H9F2NO2 Molecular Weight (g/mol): 201.173 MDL Number: MFCD09258725 InChI Key: SQCQKFZIDMTPGR-UHFFFAOYSA-N Synonym: 3-ethoxy-2,4-difluorobenzamide, jrd PubChem CID: 46737642 IUPAC Name: 3-ethoxy-2,4-difluorobenzamide SMILES: CCOC1=C(C=CC(=C1F)C(=O)N)F

Alfa Aesar™ 3,4-Dichlorobenzamide, 97%

CAS: 2670-38-4 Molecular Formula: C7H5Cl2NO Molecular Weight (g/mol): 190.023 MDL Number: MFCD00053009 InChI Key: XURBWYCGQQXTHJ-UHFFFAOYSA-N Synonym: benzamide, 3,4-dichloro, acmc-20anfl, pubchem3462, 3,4-dichloro benzamide, benzamide,3,4-dichloro, 3,4-bis chloranyl benzamide PubChem CID: 137671 IUPAC Name: 3,4-dichlorobenzamide SMILES: C1=CC(=C(C=C1C(=O)N)Cl)Cl

Alfa Aesar™ 4-Chloro-2,5-difluorobenzoic acid, 98%

CAS: 132794-07-1 Molecular Formula: C7H3ClF2O2 Molecular Weight (g/mol): 192.546 MDL Number: MFCD00077480 InChI Key: PEPCYJSDHYMIFN-UHFFFAOYSA-N Synonym: 2,5-difluoro-4-chlorobenzoic acid, 4-chloro-2,5-difluorobenzoicacid, 4-chloro-2,5-difluoro-benzoic acid, benzoic acid, 4-chloro-2,5-difluoro, pubchem1367, intermediates-zcf02018, acmc-1c2s0, 2,5-difluoro-4-chlorobenzoicacid, attercop-chm at136451, 2,5-difluoro-4-chloro-benzoic acid PubChem CID: 2733274 IUPAC Name: 4-chloro-2,5-difluorobenzoic acid SMILES: C1=C(C(=CC(=C1F)Cl)F)C(=O)O

Alfa Aesar™ 4-Chloro-N-cyclohexyl-N-methyl-3-nitrobenzamide, 97%

CAS: 41614-18-0 Molecular Formula: C14H17ClN2O3 Molecular Weight (g/mol): 296.751 MDL Number: MFCD01211935 InChI Key: YPYXOOOTWPRAEX-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrophenyl-n-cyclohexyl-n-methylcarboxamide PubChem CID: 3405764 IUPAC Name: 4-chloro-N-cyclohexyl-N-methyl-3-nitrobenzamide SMILES: CN(C1CCCCC1)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Alfa Aesar™ Methyl 4-bromo-3-methylbenzoate, 97%

CAS: 148547-19-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00673014 InChI Key: GTZTYNPAPQKIIR-UHFFFAOYSA-N Synonym: 4-bromo-3-methylbenzoic acid methyl ester, methyl4-bromo-3-methylbenzoate, methyl 4-bromo-m-toluate, 4-bromo-3-methyl-benzoic acid methyl ester, methyl 4-bromo-3-methyl-benzoate, 4-bromo-m-toluic acid methyl ester, benzoic acid, 4-bromo-3-methyl-, methyl ester, 2-bromo-5-methoxycarbonyl toluene, 3-methyl-4-bromobenzoic acid methyl ester, pubchem3970 PubChem CID: 3294148 IUPAC Name: methyl 4-bromo-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)Br

Alfa Aesar™ 4-Fluoro-2-iodobenzoic acid, 97%

CAS: 56096-89-0 Molecular Formula: C7H4FIO2 Molecular Weight (g/mol): 266.01 MDL Number: MFCD04108278 InChI Key: DUKFTVLJAXWGPI-UHFFFAOYSA-N Synonym: 4-fluoro-2-iodo-benzoic acid, 2-iodo-4-fluorobenzoic acid, 4-fluoro-2-iodobenzoicacid, benzoic acid, 4-fluoro-2-iodo, benzoic acid, 4-fluoroiodo, pubchem1389, acmc-1atr7, ksc494a9j, benzoic acid,4-fluoro-2-iodo, buttpark 83\07-33 PubChem CID: 12520164 IUPAC Name: 4-fluoro-2-iodobenzoic acid SMILES: C1=CC(=C(C=C1F)I)C(=O)O

4-Fluorobenzamide, 98%, ACROS Organics™

CAS: 824-75-9 Molecular Formula: C7H6FNO Molecular Weight (g/mol): 139.13 MDL Number: MFCD00007992 InChI Key: VNDHYTGVCGVETQ-UHFFFAOYSA-N Synonym: p-fluorobenzamide, benzamide, 4-fluoro, benzamide, p-fluoro, p-fluorobenzoic acid amide, 4-fluoro-benzamide, unii-yb79f3xb1g, yb79f3xb1g, 4fluorobenzamide, 4-fluorobenzoamide, pubchem3407 PubChem CID: 71572 IUPAC Name: 4-fluorobenzamide SMILES: C1=CC(=CC=C1C(=O)N)F

Alfa Aesar™ 4-Chloro-N-(2-ethylhexyl)-3-nitrobenzamide, 97%

CAS: 449794-75-6 Molecular Formula: C15H21ClN2O3 Molecular Weight (g/mol): 312.794 MDL Number: MFCD01182374 InChI Key: XOGLBFUDOWUBEC-UHFFFAOYSA-N Synonym: 4-chloro-n-2-ethylhexyl-3-nitrobenzamide PubChem CID: 4095209 IUPAC Name: 4-chloro-N-(2-ethylhexyl)-3-nitrobenzamide SMILES: CCCCC(CC)CNC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Alfa Aesar™ N-Cyclohexyl-4-fluorobenzamide, 97%

CAS: 2342-50-9 Molecular Formula: C13H16FNO Molecular Weight (g/mol): 221.275 MDL Number: MFCD00544070 InChI Key: STPFPZKUYANAOR-UHFFFAOYSA-N Synonym: benzamide, n-cyclohexyl-4-fluoro, n-cyclohexyl 4-fluorophenyl carboxamide PubChem CID: 2305489 IUPAC Name: N-cyclohexyl-4-fluorobenzamide SMILES: C1CCC(CC1)NC(=O)C2=CC=C(C=C2)F

Alfa Aesar™ 4-Chloro-3-ethoxy-2-fluorobenzoyl chloride, 97%

CAS: 1323966-42-2 Molecular Formula: C9H7Cl2FO2 Molecular Weight (g/mol): 237.051 MDL Number: MFCD19687216 InChI Key: XTWYKHZMPKQVSM-UHFFFAOYSA-N PubChem CID: 66523586 IUPAC Name: 4-chloro-3-ethoxy-2-fluorobenzoyl chloride SMILES: CCOC1=C(C=CC(=C1F)C(=O)Cl)Cl

Alfa Aesar™ 2-Fluoro-5-(methylcarbamoyl)benzeneboronic acid, 98%

CAS: 874289-40-4 Molecular Formula: C8H9BFNO3 Molecular Weight (g/mol): 196.972 MDL Number: MFCD08436028 InChI Key: YOQRSSHEHKHAGS-UHFFFAOYSA-N Synonym: 2-fluoro-5-methylcarbamoyl phenyl boronic acid, n-methyl 3-borono-4-fluorobenzamide, 2-fluoro-5-methylcarbamoyl phenylboronic acid, 2-fluoro-5-methylcarbamoyl benzeneboronic acid, boronic acid,b-2-fluoro-5-methylamino carbonyl phenyl, acmc-209qmi, n-methyl-3-borono-4-fluorobenzamide, 2-fluoro-5-methylcarbamoyl phenyl boronicacid, 2-fluoranyl-5-methylcarbamoyl phenyl boronic acid PubChem CID: 44717464 IUPAC Name: [2-fluoro-5-(methylcarbamoyl)phenyl]boronic acid SMILES: B(C1=C(C=CC(=C1)C(=O)NC)F)(O)O

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