3-halobenzoic acids and derivatives

Alfa Aesar™ Methyl 3,5-dibromo-4-methylbenzoate, 98%

CAS: 74896-66-5 Molecular Formula: C9H8Br2O2 Molecular Weight (g/mol): 307.969 MDL Number: MFCD00010729 InChI Key: SRLAXDDPVYZYNI-UHFFFAOYSA-N Synonym: 3,5-dibromo-4-methylbenzoic acid methyl ester, methyl 3,5-dibromo-p-toluate, 3,5-dibromo-p-toluic acid methyl ester, pubchem4611, methyl3,5-dibromo-4-methylbenzoate, acmc-1bm25, zerenex e/9072914, methyl 3,5-dibromo-4-methyl-benzoate, methyl 3,5-bis bromanyl-4-methyl-benzoate, 2,6-dibromo-4-methoxycarbonyl toluene PubChem CID: 624016 IUPAC Name: methyl 3,5-dibromo-4-methylbenzoate SMILES: CC1=C(C=C(C=C1Br)C(=O)OC)Br

3-Bromobenzoic acid, 99%, ACROS Organics™

CAS: 585-76-2 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD00002487 InChI Key: VOIZNVUXCQLQHS-UHFFFAOYSA-N Synonym: m-bromobenzoic acid, 3-brombenzoic acid, benzoic acid, 3-bromo, 3-bromo-benzoic acid, benzoic acid, m-bromo, unii-7dct3a73lx, 7dct3a73lx, 3-bromo benzene acid, 3-bromobenzoicacid, 4-fluorobenzoicacid PubChem CID: 11456 IUPAC Name: 3-bromobenzoic acid SMILES: C1=CC(=CC(=C1)Br)C(=O)O

Alfa Aesar™ Methyl 2-amino-4,5-difluorobenzoate, 98%

CAS: 207346-42-7 Molecular Formula: C8H7F2NO2 Molecular Weight (g/mol): 187.146 MDL Number: MFCD09264511 InChI Key: VIAQNTRKUPBQKR-UHFFFAOYSA-N Synonym: 2-amino-4,5-difluorobenzoic acid methyl ester, benzoic acid, 2-amino-4,5-difluoro-, methyl ester, pubchem4676, acmc-209fdn, ksc496g7j, methyl 4,5-difluoroanthranilate, methyl2-amino-4,5-difluorobenzoate, methyl 2-amino-4,5-difluoro-benzoate, 2-amino-4,5-difluoro-benzoic acid methyl ester PubChem CID: 18472001 IUPAC Name: methyl 2-amino-4,5-difluorobenzoate SMILES: COC(=O)C1=CC(=C(C=C1N)F)F

Alfa Aesar™ Methyl 3-cyano-5-fluorobenzoate, 98%

CAS: 886732-29-2 Molecular Formula: C9H6FNO2 Molecular Weight (g/mol): 179.15 MDL Number: MFCD08688582 InChI Key: YZDWAFGKJVAXAM-UHFFFAOYSA-N Synonym: 3-cyano-5-fluorobenzoic acid methyl ester, benzoic acid, 3-cyano-5-fluoro-, methyl ester PubChem CID: 26597287 IUPAC Name: methyl 3-cyano-5-fluorobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)C#N)F

Alfa Aesar™ 3-Bromo-5-fluorobenzamide, 96%

CAS: 933585-20-7 Molecular Formula: C7H5BrFNO Molecular Weight (g/mol): 218.025 MDL Number: MFCD07780673 InChI Key: CFWMRENFPXKUBG-UHFFFAOYSA-N PubChem CID: 43248499 IUPAC Name: 3-bromo-5-fluorobenzamide SMILES: C1=C(C=C(C=C1F)Br)C(=O)N

Alfa Aesar™ 4-Ethoxy-2,3-difluorobenzoyl chloride, 97%

CAS: 761459-04-5 Molecular Formula: C9H7ClF2O2 Molecular Weight (g/mol): 220.6 MDL Number: MFCD09258701 InChI Key: BTIZLROTPPAIEJ-UHFFFAOYSA-N Synonym: 4-ethoxy-2,3-difluorobenzoyl chloride, jrd PubChem CID: 19763022 IUPAC Name: 4-ethoxy-2,3-difluorobenzoyl chloride SMILES: CCOC1=C(C(=C(C=C1)C(=O)Cl)F)F

Alfa Aesar™ 3,5-Dibromobenzamide, 97%

CAS: 175205-85-3 Molecular Formula: C7H5Br2NO Molecular Weight (g/mol): 278.931 MDL Number: MFCD00178771 InChI Key: IOFGMNBDIDEBIQ-UHFFFAOYSA-N Synonym: 3,5-dibromo-benzoic acid amide, acmc-20andi, 3,5-dibromo-benzamide, maybridge1_007750, 3,5-bis bromanyl benzamide, 3,5-dibromobenzamide PubChem CID: 2735937 IUPAC Name: 3,5-dibromobenzamide SMILES: C1=C(C=C(C=C1Br)Br)C(=O)N

Alfa Aesar™ 2-Fluoro-4-(methoxycarbonyl)benzeneboronic acid, 98%

CAS: 603122-84-5 Molecular Formula: C8H8BFO4 Molecular Weight (g/mol): 197.956 MDL Number: MFCD08436034 InChI Key: BKWRLCIYMAYFPA-UHFFFAOYSA-N Synonym: 2-fluoro-4-methoxycarbonyl phenylboronic acid, 2-fluoro-4-methoxycarbonyl benzeneboronic acid, 4-methoxycarbonyl-2-fluorophenylboronic acid, 2-fluoro-4-methoxycarbonyl phenyl boronic acid, o-fluoro p-methoxy carbonyl phenyl boronic acid, pubchem17434, acmc-209mj4, 2-fluoro-4-methoxycarbonyl phenylboronicacid, 2-fluoro-4-methoxycarbonyl-phenylboronic acid PubChem CID: 24824345 IUPAC Name: (2-fluoro-4-methoxycarbonylphenyl)boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)OC)F)(O)O

Alfa Aesar™ Ethyl 3-bromobenzoate, 98+%

CAS: 24398-88-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00013529 InChI Key: QAUASTLEZAPQTB-UHFFFAOYSA-N Synonym: ethyl3-bromobenzoate, 3-bromobenzoic acid ethyl ester, benzoic acid, 3-bromo-, ethyl ester, ethyl-3-bromobenzoate, benzoic acid, m-bromo-, ethyl ester, m-bromo benzoic acid ethyl ester, m-bromobenzoic acid, ethyl ester, pubchem3941, acmc-209gbv, ethyl 3-bromobenzoate PubChem CID: 90488 IUPAC Name: ethyl 3-bromobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)Br

Alfa Aesar™ 2,3-Difluoro-4-methylbenzoyl chloride, 97%

CAS: 261763-38-6 Molecular Formula: C8H5ClF2O Molecular Weight (g/mol): 190.574 MDL Number: MFCD01631645 InChI Key: IHRMSSGDXMQPBA-UHFFFAOYSA-N Synonym: 2,3-difluoro-4-methyl-benzoyl chloride, acmc-20aogw, 2,3-difluoro-p-toluoyl chloride, 2,3-difluoro-4-methylbenzoylchloride, benzoyl chloride,2,3-difluoro-4-methyl, benzoyl chloride, 2,3-difluoro-4-methyl, 2,3-bis fluoranyl-4-methyl-benzoyl chloride, 2,3-difluoro-4-methylbenzoyl chloride, benzoyl chloride, 2,3-difluoro-4-methyl-9ci PubChem CID: 2774144 IUPAC Name: 2,3-difluoro-4-methylbenzoyl chloride SMILES: CC1=C(C(=C(C=C1)C(=O)Cl)F)F

Alfa Aesar™ Ethyl 3-chlorobenzoate, 98+%

CAS: 1128-76-3 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00013634 InChI Key: LVFRSNCBCHABAM-UHFFFAOYSA-N Synonym: benzoic acid, 3-chloro-, ethyl ester, 3-chlorobenzoic acid ethyl ester, ethyl m-chlorobenzoate, benzoic acid, m-chloro-, ethyl ester, 3-chloro-benzoic acid ethyl ester, pubchem3704, acmc-1bt4u, ethyl3-chlorobenzoate, ksc495m6f, rarechem al bi 0056 PubChem CID: 70785 IUPAC Name: ethyl 3-chlorobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)Cl

Alfa Aesar™ 3-Fluoro-4-(trifluoromethoxy)benzoic acid, 97%

CAS: 886498-89-1 Molecular Formula: C8H4F4O3 Molecular Weight (g/mol): 224.111 MDL Number: MFCD06660202 InChI Key: PIBFTHWKVKHHMA-UHFFFAOYSA-N Synonym: 3-fluoro-4-trifluoromethoxy benzoic acid, 3-fluoro-4-trifluoromethoxy-benzoic acid, 3-fluoro-4-trifluoromethoxy benzoicacid, benzoic acid,3-fluoro-4-trifluoromethoxy, benzoic acid, 3-fluoro-4-trifluoromethoxy PubChem CID: 2783356 IUPAC Name: 3-fluoro-4-(trifluoromethoxy)benzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)OC(F)(F)F

Alfa Aesar™ 5-Chloro-2-fluorobenzamide, 97+%

CAS: 261762-57-6 Molecular Formula: C7H5ClFNO Molecular Weight (g/mol): 173.571 MDL Number: MFCD01631435 InChI Key: VTSILFLCXIRODM-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzamide, pubchem9136, 5-chloranyl-2-fluoranyl-benzamide, 5-chloro-2-fluorobenzamide,97+% PubChem CID: 2773592 IUPAC Name: 5-chloro-2-fluorobenzamide SMILES: C1=CC(=C(C=C1Cl)C(=O)N)F

Alfa Aesar™ 2-Fluoro-4-(4-fluoro-2-nitrophenylcarbamoyl)benzeneboronic acid, 97%

CAS: 1449144-94-8 Molecular Formula: C13H9BF2N2O5 Molecular Weight (g/mol): 322.031 MDL Number: MFCD20040308 InChI Key: JSRCTYHYPFPKJW-UHFFFAOYSA-N Synonym: 2-fluoro-4-4-fluoro-2-nitrophenylcarbamoyl benzeneboronic acid, 2-fluoro-4-4-fluoro-2-nitrophenyl carbamoyl phenylboronic acid PubChem CID: 73996130 IUPAC Name: [2-fluoro-4-[(4-fluoro-2-nitrophenyl)carbamoyl]phenyl]boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)F)[N+](=O)[O-])F)(O)O

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

CAS: 1017779-57-5 Molecular Formula: C9H9F2NO2 Molecular Weight (g/mol): 201.173 MDL Number: MFCD09258702 InChI Key: PFXUEERRMBKGOD-UHFFFAOYSA-N Synonym: 4-ethoxy-2,3-difluorobenzamide, jrd PubChem CID: 46737619 IUPAC Name: 4-ethoxy-2,3-difluorobenzamide SMILES: CCOC1=C(C(=C(C=C1)C(=O)N)F)F

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

CAS: 216393-55-4 Molecular Formula: C8H6F2O2 Molecular Weight (g/mol): 172.131 MDL Number: MFCD01318160 InChI Key: JBEJPGWPXIIQBB-UHFFFAOYSA-N Synonym: 3,5-difluorobenzoic acid methyl ester, benzoic acid, 3,5-difluoro-, methyl ester, acmc-209fmq, methyl-3,5-difluorophenylacetate, methyl-3,5-difluorobenzoate, 3,5-difluorobenzoicacid methyl ester, benzoic acid,3,5-difluoro-, methyl ester PubChem CID: 2775360 IUPAC Name: methyl 3,5-difluorobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)F)F

Alfa Aesar™ Methyl 3-bromo-4-methylbenzoate, 99%

CAS: 104901-43-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00144769 InChI Key: MASRAGFWFYHMFI-UHFFFAOYSA-N Synonym: 3-bromo-4-methylbenzoic acid methyl ester, methyl 3-bromo-p-toluate, methyl3-bromo-4-methylbenzoate, benzoic acid, 3-bromo-4-methyl-, methyl ester, 3-bromo-p-toluic acid methyl ester, 3-bromo-4-methyl methyl benzoate, 3-bromo-4-methyl-benzoic acid methyl ester, pubchem3967, acmc-2098dw, methyl 3-bromo4-methylbenzoate PubChem CID: 7015747 IUPAC Name: methyl 3-bromo-4-methylbenzoate SMILES: CC1=C(C=C(C=C1)C(=O)OC)Br

Alfa Aesar™ 3-Fluoro-5-(methylcarbamoyl)benzeneboronic acid, 98%

CAS: 871332-63-7 Molecular Formula: C8H9BFNO3 Molecular Weight (g/mol): 196.972 MDL Number: MFCD07363793 InChI Key: CDJLVNMKXZMCHU-UHFFFAOYSA-N Synonym: 3-fluoro-5-methylcarbamoyl phenylboronic acid, 3-fluoro-5-methylcarbamoyl phenyl boronic acid, 3-fluoro-5-methylcarbamoyl benzeneboronic acid, n-methyl 3-borono-5-fluorobenzamide, 3-fluoro-5-methylaminocarbonyl phenylboronic acid, acmc-209qgt, 3-fluoro-5-methylcarbamoyl benzene boronic acid, 3-fluoro-5-methylcarbamoyl-phenyl boronic acid, 3-fluoro-5-methyl carbamoyl phenylboronic acid PubChem CID: 44886927 IUPAC Name: [3-fluoro-5-(methylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC(=CC(=C1)F)C(=O)NC)(O)O

Alfa Aesar™ 3,5-Dichlorobenzoyl chloride, 96%

CAS: 2905-62-6 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00009817 InChI Key: GGHLXLVPNZMBQR-UHFFFAOYSA-N Synonym: benzoyl chloride, 3,5-dichloro, 3,5-dichlorobenzoylchloride, dichlorobenzoylchloride 3,5-, pubchem10805, dsstox_cid_7506, acmc-209h6l, dsstox_rid_78478, dsstox_gsid_27506, ksc204k6p, 3,5-dichloro benzoyl chloride PubChem CID: 76191 IUPAC Name: 3,5-dichlorobenzoyl chloride SMILES: C1=C(C=C(C=C1Cl)Cl)C(=O)Cl

Alfa Aesar™ 3-Fluoro-2-methoxybenzoic acid, 98%

CAS: 106428-05-1 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.139 MDL Number: MFCD00973972 InChI Key: MEOOXZGGYVXUSG-UHFFFAOYSA-N Synonym: 3-fluoro-2-methoxybenzoicacid, 3-fluoro-2-methoxy-benzoic acid, fluoro-methoxybenzoic acid, acmc-1bo0c, buttpark 20\01-60, benzoic acid,3-fluoro-2-methoxy, 3-fluoro-2-methyloxy benzoic acid, benzoic acid, 3-fluoro-2-methoxy PubChem CID: 2737361 IUPAC Name: 3-fluoro-2-methoxybenzoic acid SMILES: COC1=C(C=CC=C1F)C(=O)O

3-Bromo-4-methylbenzoic acid, 98%, ACROS Organics™

CAS: 7697-26-9 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 InChI Key: ZFJOMUKPDWNRFI-UHFFFAOYSA-N Synonym: 3-bromo-4-methylbenzoicacid, 3-bromo-p-toluic acid, benzoic acid, 3-bromo-4-methyl, 3-bromo-4-methyl-benzoic acid, bromo-p-toluic acid, pubchem3806, bromo-para-toluic acid, 3-bromo4-methylbenzoic acid, acmc-1bg95, akos bbb/219 PubChem CID: 82130 IUPAC Name: 3-bromo-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)C(=O)O)Br

Alfa Aesar™ Ethyl 5-bromo-2-chlorobenzoate, 98+%

CAS: 76008-73-6 Molecular Formula: C9H8BrClO2 Molecular Weight (g/mol): 263.515 MDL Number: MFCD00013635 InChI Key: AMGWDYLEMSMUIO-UHFFFAOYSA-N Synonym: 5-bromo-2-chlorobenzoic acid ethyl ester, ethyl5-bromo-2-chlorobenzoate, benzoic acid, 5-bromo-2-chloro-, ethyl ester, pubchem3702, acmc-1bb9d, ethyl-5-bromo-2-chlorobenzoate, ethyl 5-bromo-2-chloro-benzoate, a-ethyl 5-bromo-2-chlorobenzoate, attercop-chm at115127, ethyl 5-bromo2-chlorobenzaldehyde PubChem CID: 144749 IUPAC Name: ethyl 5-bromo-2-chlorobenzoate SMILES: CCOC(=O)C1=C(C=CC(=C1)Br)Cl

Alfa Aesar™ Methyl 3-amino-5-fluorobenzoate, 98%

CAS: 884497-46-5 Molecular Formula: C8H8FNO2 Molecular Weight (g/mol): 169.155 MDL Number: MFCD05863683 InChI Key: YKEJVXMOMKWEPV-UHFFFAOYSA-N Synonym: methyl3-amino-5-fluorobenzoate, methyl 5-amino-3-fluorobenzoate, 5-amino-3-fluorobenzoic acid methyl ester, 3-amino-5-fluoro-benzoic acid methyl ester PubChem CID: 3807862 IUPAC Name: methyl 3-amino-5-fluorobenzoate SMILES: COC(=O)C1=CC(=CC(=C1)F)N

Alfa Aesar™ Methyl 2,5-dichlorobenzoate, 99%

CAS: 2905-69-3 Molecular Formula: C8H6Cl2O2 Molecular Weight (g/mol): 205.034 MDL Number: MFCD00000606 InChI Key: SPJQBGGHUDNAIC-UHFFFAOYSA-N Synonym: 2,5-dichlorobenzoic acid methyl ester, benzoic acid, 2,5-dichloro-, methyl ester, methyl-2,5-dichlorobenzoate, unii-j07555o4he, benzoic acid, dichloro-, methyl ester, pubchem3714, acmc-1bhkt, 2,5-dcbme, rarechem al bf 0427, methyl 2,5-bis chloranyl benzoate PubChem CID: 17947 IUPAC Name: methyl 2,5-dichlorobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)Cl)Cl

Methyl 3-bromobenzoate, 98%, ACROS Organics™

CAS: 618-89-3 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00017777 InChI Key: KMFJVYMFCAIRAN-UHFFFAOYSA-N Synonym: methyl m-bromobenzoate, 3-bromobenzoic acid methyl ester, benzoic acid, 3-bromo-, methyl ester, 3-bromobenzoic acid, methyl ester, methyl-3-bromobenzoate, benzoic acid, m-bromo-, methyl ester, m-bromobenzoic acid methyl ester, pubchem3961, methyl m-bromo benzoate, methyl 3-bromo-benzoate PubChem CID: 12070 IUPAC Name: methyl 3-bromobenzoate SMILES: COC(=O)C1=CC(=CC=C1)Br

3-Bromo-2,6-dimethoxybenzoic acid, ≥97%, Maybridge™

CAS: 73219-89-3 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.071 MDL Number: MFCD00052933 InChI Key: CUQANLQRQJHIQE-UHFFFAOYSA-N Synonym: maybridge1_001596, acmc-1bfe7, 2,6-dimethoxy-3-bromobenzoic acid, benzoic acid,3-bromo-2,6-dimethoxy, benzoic acid, 3-bromo-2,6-dimethoxy PubChem CID: 2774744 IUPAC Name: 3-bromo-2,6-dimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)Br)OC)C(=O)O

Alfa Aesar™ 3-Chloro-4-ethoxy-5-fluorobenzoic acid, 97%

CAS: 1017778-72-1 Molecular Formula: C9H8ClFO3 Molecular Weight (g/mol): 218.608 MDL Number: MFCD09832336 InChI Key: UZGWOMNUSFRIRW-UHFFFAOYSA-N Synonym: 3-chloro-4-ethoxy-5-fluorobenzoic acid, jrd PubChem CID: 46737656 IUPAC Name: 3-chloro-4-ethoxy-5-fluorobenzoic acid SMILES: CCOC1=C(C=C(C=C1Cl)C(=O)O)F

Alfa Aesar™ N-Ethyl-2,5-difluorobenzamide, 97%

CAS: 948717-61-1 Molecular Formula: C9H9F2NO Molecular Weight (g/mol): 185.174 MDL Number: MFCD11843991 InChI Key: VMNRGEZTDCWQLU-UHFFFAOYSA-N Synonym: benzamide, 2,5-difluoro-n-ethyl PubChem CID: 17683297 IUPAC Name: N-ethyl-2,5-difluorobenzamide SMILES: CCNC(=O)C1=C(C=CC(=C1)F)F

Alfa Aesar™ 3-Fluoro-2-methylbenzoic acid, 98%

CAS: 699-90-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00075246 InChI Key: XMKZAIHFVHJGPV-UHFFFAOYSA-N Synonym: 3-fluoro-2-methyl-benzoic acid, 2-methyl-3-fluoro benzoic acid, 3-fluoro-2-methylbenzoicacid, benzoic acid, 3-fluoro-2-methyl, 6-fluortoluylsaure, pubchem1329, 2-carboxy-6-fluorotoluene, acmc-209oc1, ksc352q5t, 2-methyl-3-fluorobenzoic acid PubChem CID: 246682 IUPAC Name: 3-fluoro-2-methylbenzoic acid SMILES: CC1=C(C=CC=C1F)C(=O)O

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

CAS: 7499-07-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00045852 InChI Key: HXGHMCLCSPQMOR-UHFFFAOYSA-N Synonym: 3-chloro-o-toluic acid, 3-chloro-2-methyl-benzoic acid, benzoic acid, 3-chloro-2-methyl, o-toluic acid, 3-chloro, 3-chloro-2-methylbenzoicacid, 2-methyl-3-chlorobenzoic acid, pubchem8362, 2-carboxy-6-chlorotoluene, 3chloro-2-methylbenzoic acid, 3-chloro-2-methybenzoic acid PubChem CID: 82010 IUPAC Name: 3-chloro-2-methylbenzoic acid SMILES: CC1=C(C=CC=C1Cl)C(=O)O

  spinner