4-halobenzoic acids and derivatives

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-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

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-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

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™ 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

Methyl 4-bromobenzoate, 99%, ACROS Organics™

CAS: 619-42-1 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00013531 InChI Key: CZNGTXVOZOWWKM-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-, methyl ester, methyl p-bromobenzoate, 4-bromobenzoic acid methyl ester, p-bromobenzoic acid, methyl ester, unii-ub1ysj5xar, ub1ysj5xar, benzoic acid, p-bromo-, methyl ester, pubchem3962, methyl-4-bromobenzoate, methyl p-bromo benzoate PubChem CID: 12081 IUPAC Name: methyl 4-bromobenzoate SMILES: COC(=O)C1=CC=C(C=C1)Br

Alfa Aesar™ 4-Fluorobenzoyl chloride, 98%

CAS: 403-43-0 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.556 MDL Number: MFCD00000684 InChI Key: CZKLEJHVLCMVQR-UHFFFAOYSA-N Synonym: benzoyl chloride, 4-fluoro, p-fluorobenzoyl chloride, benzoyl chloride, p-fluoro, p-fluorobenzoic acid chloride, 4-fluorobenzoylchloride, fluorobenzoyl 4-chloride, 4-fluorobenzoic acid chloride, p-fluorobenzoylchloride, p-fluorobenzoyl choride, 4-flurobenzoyl chloride PubChem CID: 67879 IUPAC Name: 4-fluorobenzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)F

Alfa Aesar™ 4-Bromo-2-methylbenzoic acid, 98+%

CAS: 68837-59-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00040905 InChI Key: RVCJOGNLYVNRDN-UHFFFAOYSA-N Synonym: 2-methyl-4-bromobenzoic acid, 4-bromo-o-toluic acid, 4-bromo-2-methyl-benzoic acid, benzoic acid, 4-bromo-2-methyl, synquest 2721-9-x6, 4-bromo-2-methylbenz, 4-bromo-2-methylbenzoicacid, pubchem4029, 5-bromo-2-carboxytoluene, acmc-1baz5 PubChem CID: 99570 IUPAC Name: 4-bromo-2-methylbenzoic acid SMILES: CC1=C(C=CC(=C1)Br)C(=O)O

Furosemide, 97+%, ACROS Organics™

CAS: 54-31-9 Molecular Formula: C12H11ClN2O5S Molecular Weight (g/mol): 330.74 InChI Key: ZZUFCTLCJUWOSV-UHFFFAOYSA-N Synonym: furosemide, frusemide, lasix, furosemid, furanthril, errolon, fusid, aisemide, beronald, desdemin PubChem CID: 3440 ChEBI: CHEBI:47426 IUPAC Name: 4-chloro-2-(furan-2-ylmethylamino)-5-sulfamoylbenzoic acid SMILES: C1=COC(=C1)CNC2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl

Alfa Aesar™ 2-Bromo-4-fluorobenzamide, 96%

CAS: 1006-40-2 Molecular Formula: C7H5BrFNO Molecular Weight (g/mol): 218.025 MDL Number: MFCD06409122 InChI Key: IWODMEGZVDWKPK-UHFFFAOYSA-N Synonym: benzamide, 2-bromo-4-fluoro PubChem CID: 20372234 IUPAC Name: 2-bromo-4-fluorobenzamide SMILES: C1=CC(=C(C=C1F)Br)C(=O)N

Alfa Aesar™ Methyl 4-iodo-3-methylbenzoate, 98%

CAS: 5471-81-8 Molecular Formula: C9H9IO2 Molecular Weight (g/mol): 276.073 MDL Number: MFCD02683863 InChI Key: HCSGWQGKCVQIRM-UHFFFAOYSA-N Synonym: 4-iodo-3-methylbenzoic acid methyl ester, methyl 4-iodo-3-methyl-benzoate, 4-iodo-m-toluic acid methyl ester, benzoic acid, 4-iodo-3-methyl-, methyl ester, methyl4-iodo-3-methylbenzoate, acmc-1anqa, methyl 4-iodo-m-toluate, methyl 3methyl-4-iodobenzoate, methyl 3-methyl-4-iodobenzoate, 4-iodo-m-toluic acid, methyl ester PubChem CID: 231757 IUPAC Name: methyl 4-iodo-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)I

Alfa Aesar™ Methyl 2-amino-4-chlorobenzoate, 98%

CAS: 5900-58-3 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.607 MDL Number: MFCD00017568 InChI Key: YPSSCICDVDOEAI-UHFFFAOYSA-N Synonym: methyl 4-chloroanthranilate, 2-amino-4-chloro-benzoic acid methyl ester, methyl2-amino-4-chlorobenzoate, benzoic acid, 2-amino-4-chloro-, methyl ester, 2-amino-4-chlorobenzoic acid methyl ester, pubchem4643, methyl 4-chloro-anthranilate, methyl 2-amino4-chlorobenzoate, methyl-2-amino-4-chlorobenzoate PubChem CID: 80001 IUPAC Name: methyl 2-amino-4-chlorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Cl)N

Alfa Aesar™ 2,3,4,5-Tetrafluorobenzamide, 97+%

CAS: 16582-94-8 Molecular Formula: C7H3F4NO Molecular Weight (g/mol): 193.101 MDL Number: MFCD01631457 InChI Key: XMFMIKSWEJRJQE-UHFFFAOYSA-N Synonym: acmc-1c7cs, benzamide,2,3,4,5-tetrafluoro PubChem CID: 2776581 IUPAC Name: 2,3,4,5-tetrafluorobenzamide SMILES: C1=C(C(=C(C(=C1F)F)F)F)C(=O)N

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

CAS: 349089-31-2 Molecular Formula: C19H26ClNO Molecular Weight (g/mol): 319.873 MDL Number: MFCD00540918 InChI Key: BMQOLGWVHWPNTP-UHFFFAOYSA-N PubChem CID: 2189789 IUPAC Name: 4-chloro-N,N-dicyclohexylbenzamide SMILES: C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)Cl

Alfa Aesar™ 2,4-Difluoro-5-iodobenzoic acid, 97%

CAS: 161531-51-7 Molecular Formula: C7H3F2IO2 Molecular Weight (g/mol): 284 MDL Number: MFCD11226506 InChI Key: OSBABFNFGBPWGL-UHFFFAOYSA-N Synonym: 2,4-difluoro-5-iodo-benzoic acid, 5-iodo-2,4-difluorobenzoic acid, benzoic acid, 2,4-difluoro-5-iodo PubChem CID: 11129795 IUPAC Name: 2,4-difluoro-5-iodobenzoic acid SMILES: C1=C(C(=CC(=C1I)F)F)C(=O)O

Alfa Aesar™ 4-Fluoro-3-methylbenzoyl chloride, 97%

CAS: 455-84-5 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.583 MDL Number: MFCD01631426 InChI Key: FMFLKTDRPXYUGP-UHFFFAOYSA-N Synonym: 4-fluoro-3-methylbenzoylchloride, 4-fluoro-m-toluoyl chloride, 4-fluoro-3-methyl-benzoyl chloride, benzoyl chloride, 4-fluoro-3-methyl, acmc-1arwr, 5-chlorocarbonyl-2-fluorotoluene, 4-fluoranyl-3-methyl-benzoyl chloride, 4-fluoro-3-methyl benzoyl chloride, 4-fluoro-3-methyl-benzoic acid chloride, 4-fluoro-3-methylbenzoyl chloride PubChem CID: 2774589 IUPAC Name: 4-fluoro-3-methylbenzoyl chloride SMILES: CC1=C(C=CC(=C1)C(=O)Cl)F

Alfa Aesar™ Methyl 4-bromo-2-methoxybenzoate, 98%

CAS: 139102-34-4 Molecular Formula: C9H9BrO3 Molecular Weight (g/mol): 245.072 MDL Number: MFCD06797867 InChI Key: WPGAGRPPDYAZAD-UHFFFAOYSA-N Synonym: methyl4-bromo-2-methoxybenzoate, benzoic acid, 4-bromo-2-methoxy-, methyl ester, 4-bromo-2-methoxybenzoic acid methyl ester, ablock ab-14-0789, benzoic acid,4-bromo-2-methoxy-, methyl ester, pubchem16069, acmc-209ciq, methyl-4-bromo-2-methoxybenzoate, zerenex e/1100188, 4-bromo-2-methoxybenzoate 98 PubChem CID: 15128242 IUPAC Name: methyl 4-bromo-2-methoxybenzoate SMILES: COC1=C(C=CC(=C1)Br)C(=O)OC

Alfa Aesar™ 2,4,5-Trifluorobenzoyl chloride, 98%

CAS: 88419-56-1 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.537 MDL Number: MFCD00061204 InChI Key: STBGCAUUOPNJBH-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobenzoylchloride, benzoyl chloride, 2,4,5-trifluoro, 2,4,5-tris fluoranyl benzoyl chloride, pubchem9716, acmc-209qt0, 2,4,5-trifluorobenzoyl-chloride, stbgcauuopnjbh-uhfffaoysa, timtec-bb sbb006657, 2,4,5-trifluoro-benzoyl chloride, 2,4,5-trifluorobenzoyl chloride PubChem CID: 145164 IUPAC Name: 2,4,5-trifluorobenzoyl chloride SMILES: C1=C(C(=CC(=C1F)F)F)C(=O)Cl

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

CAS: 2252-51-9 Molecular Formula: C7H4ClFO2 Molecular Weight (g/mol): 174.555 MDL Number: MFCD00010615 InChI Key: GRPWQLDSGNZEQE-UHFFFAOYSA-N Synonym: benzoic acid, 2-chloro-4-fluoro, 2-chloro-4-fluoro-benzoic acid, 2-chloro-4-fluor obenzoic acid, pubchem1370, acmc-209fx5, ksc207e4n, rarechem al bo 0405, 2-chloro 4-fluoro benzoic acid, 2-chloro-4-fluoro benzoic acid, 4-fluoro-2-chloro-benzoic acid PubChem CID: 75259 IUPAC Name: 2-chloro-4-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)Cl)C(=O)O

Alfa Aesar™ 2-Bromo-4-chlorobenzoic acid, 97%

CAS: 936-08-3 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00672930 InChI Key: USMQLFCVCDEXAK-UHFFFAOYSA-N Synonym: 2-bromo-4-chloro-benzoic acid, benzoic acid, 2-bromo-4-chloro, 2-bromo-4-chlorobenzoicacid, pubchem4028, acmc-209rmm, p-chloro bromo benzoic acid, ksc486m1d, benzoicacid, 2-bromo-4-chloro, 2-bromo-4-chlorobenzoic acid PubChem CID: 33126 IUPAC Name: 2-bromo-4-chlorobenzoic acid SMILES: C1=CC(=C(C=C1Cl)Br)C(=O)O

4-Chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide, 97%, Alfa Aesar™

CAS: 41859-57-8 Molecular Formula: C15H14ClNO2 Molecular Weight (g/mol): 275.732 MDL Number: MFCD00218513 InChI Key: ZTLWJYCDAXUIBK-UHFFFAOYSA-N Synonym: n-4-chlorobenzoyl-tyramine, 4-chloro-n-4-hydroxyphenethyl benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl benzamide, n-4-chlorobenzoyl tyramine, benzamide, p-chloro-n-2-p-hydroxyphenyl ethyl, p-chloro-n-2-p-hydroxyphenyl ethyl benzamide, benzamide, 4-chloro-n-2-4-hydroxyphenyl ethyl, bez-da PubChem CID: 198234 IUPAC Name: 4-chloro-N-[2-(4-hydroxyphenyl)ethyl]benzamide SMILES: C1=CC(=CC=C1CCNC(=O)C2=CC=C(C=C2)Cl)O

Alfa Aesar™ 4-Bromobenzamide, 97%

CAS: 698-67-9 Molecular Formula: C7H6BrNO Molecular Weight (g/mol): 200.035 MDL Number: MFCD00007991 InChI Key: ZRWNRAJCPNLYAK-UHFFFAOYSA-N Synonym: p-bromobenzamide, benzamide, 4-bromo, benzamide, p-bromo, p-bromobenzoic acid amide, 4-bromo-benzamide, 4-bromo benzamide, pubchem3737, acmc-209obe, 4-bromobenzamide, 4-bromobenzoic acid amide PubChem CID: 69683 IUPAC Name: 4-bromobenzamide SMILES: C1=CC(=CC=C1C(=O)N)Br

Alfa Aesar™ 2-Chloro-5-(cyclohexylcarbamoyl)benzeneboronic acid, 97%

CAS: 1449132-56-2 Molecular Formula: C13H17BClNO3 Molecular Weight (g/mol): 281.543 MDL Number: MFCD22125067 InChI Key: YIIFOIAEUVSORY-UHFFFAOYSA-N Synonym: 2-chloro-5-cyclohexylcarbamoyl benzeneboronic acid, 2-chloro-5-cyclohexylcarbamoyl phenylboronic acid PubChem CID: 73995803 IUPAC Name: [2-chloro-5-(cyclohexylcarbamoyl)phenyl]boronic acid SMILES: B(C1=C(C=CC(=C1)C(=O)NC2CCCCC2)Cl)(O)O

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

CAS: 874289-49-3 Molecular Formula: C10H13BFNO3 Molecular Weight (g/mol): 225.026 MDL Number: MFCD08235103 InChI Key: NCRUGKRIPMSQHI-UHFFFAOYSA-N Synonym: 2-fluoro-5-isopropylcarbamoyl phenyl boronic acid, n-isopropyl 3-borono-4-fluorobenzamide, 2-fluoro-5-isopropylcarbamoyl benzeneboronic acid, 2-fluoro-5-isopropylcarbamoyl phenylboronic acid, acmc-209qmq, 3-borono-4-fluoro-n-isopropylbenzamide, 3-borono-4-fluoro-n-propan-2-yl benzamide, 2-fluoro-5-isopropylcarbamoyl phenyl boronicacid, 2-fluoro-5-isopropylcarbamoyl-phenyl boronic acid, 2-fluoranyl-5-propan-2-ylcarbamoyl phenyl boronic acid PubChem CID: 44717605 IUPAC Name: [2-fluoro-5-(propan-2-ylcarbamoyl)phenyl]boronic acid SMILES: B(C1=C(C=CC(=C1)C(=O)NC(C)C)F)(O)O

5-[Cyclohexyl(methyl)carbamoyl]-2-fluorobenzeneboronic acid, 97%, Alfa Aesar™

CAS: 1449131-79-6 Molecular Formula: C14H19BFNO3 Molecular Weight (g/mol): 279.118 MDL Number: MFCD20040224 InChI Key: PIAHGOURQDHKCB-UHFFFAOYSA-N Synonym: 5-cyclohexyl methyl carbamoyl-2-fluorobenzeneboronic acid, 5-cyclohexyl methyl carbamoyl-2-fluorophenylboronic acid PubChem CID: 73995878 IUPAC Name: [5-[cyclohexyl(methyl)carbamoyl]-2-fluorophenyl]boronic acid SMILES: B(C1=C(C=CC(=C1)C(=O)N(C)C2CCCCC2)F)(O)O

Alfa Aesar™ 4-Bromo-3,5-difluorobenzoic acid, 96%

CAS: 651027-00-8 Molecular Formula: C7H3BrF2O2 Molecular Weight (g/mol): 237 MDL Number: MFCD18917156 InChI Key: NLLRAEQVOZOSBB-UHFFFAOYSA-N Synonym: benzoic acid, 4-bromo-3,5-difluoro, 4-bromo-3,5-difluorobenzoicacid, 3,5-difluoro-4-bromobenzoic acid PubChem CID: 11424897 IUPAC Name: 4-bromo-3,5-difluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)Br)F)C(=O)O

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

CAS: 122033-54-9 Molecular Formula: C7BrClF4O Molecular Weight (g/mol): 291.424 MDL Number: MFCD03001173 InChI Key: XVYIQLOULDERAO-UHFFFAOYSA-N Synonym: 4-bromo-2,3,5,6-tetrafluorobenzoylchloride, benzoyl chloride,4-bromo-2,3,5,6-tetrafluoro, acmc-20amnz, 4-bromanyl-2,3,5,6-tetrakis fluoranyl benzoyl chloride PubChem CID: 2783245 IUPAC Name: 4-bromo-2,3,5,6-tetrafluorobenzoyl chloride SMILES: C1(=C(C(=C(C(=C1F)F)Br)F)F)C(=O)Cl

Alfa Aesar™ Methyl 2,4-dichlorobenzoate, 97%

CAS: 35112-28-8 Molecular Formula: C8H6Cl2O2 Molecular Weight (g/mol): 205.034 MDL Number: MFCD00085117 InChI Key: VCRWILYAWSRHBN-UHFFFAOYSA-N Synonym: methyl2,4-dichlorobenzoate, 2,4-dichlorobenzoic acid methyl ester, benzoic acid, 2,4-dichloro-, methyl ester, methyl-2,4-dichlorobenzoate, pubchem3713, methyl ester of 2,4-dichlorobenzoic acid, acmc-209id8, ksc497m5b, methyl 2,4-dichloro benzoate PubChem CID: 37055 IUPAC Name: methyl 2,4-dichlorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)Cl)Cl

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