3-halobenzoic acids and derivatives

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

CAS: 886732-29-2 Fórmula molecular: C9H6FNO2 Molecular Weight (g/mol): 179.15 Número MDL: MFCD08688582 InChI Key: YZDWAFGKJVAXAM-UHFFFAOYSA-N Sinónimo: 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-Chloro-4-ethoxy-5-fluorobenzoic acid, 97%

CAS: 1017778-72-1 Fórmula molecular: C9H8ClFO3 Molecular Weight (g/mol): 218.608 Número MDL: MFCD09832336 InChI Key: UZGWOMNUSFRIRW-UHFFFAOYSA-N Sinónimo: 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

3-Fluorobenzoyl chloride, 97%, ACROS Organics™

CAS: 1711-07-5 Fórmula molecular: C7H4ClFO Molecular Weight (g/mol): 158.56 Número MDL: MFCD00000670 InChI Key: SYVNVEGIRVXRQH-UHFFFAOYSA-N Sinónimo: m-fluorobenzoyl chloride, benzoyl chloride, 3-fluoro, benzoyl chloride, m-fluoro, m-fluorobenzoic acid chloride, 3-fluorobenzoic acid chloride, 3-fluorobenzoylchloride, gvr cf, m-fluorobenzoylchloride, pubchem19742, m-fluoro-benzoylchloride PubChem CID: 74376 IUPAC Name: 3-fluorobenzoyl chloride SMILES: C1=CC(=CC(=C1)F)C(=O)Cl

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

CAS: 88487-25-6 Fórmula molecular: C7H5ClFNO Molecular Weight (g/mol): 173.571 Número MDL: MFCD01631465 InChI Key: UKUUZRYASPJJOI-UHFFFAOYSA-N Sinónimo: benzamide,2-chloro-5-fluoro, 2-carbamoyl-4-fluorochlorobenzene, pubchem9137, acmc-20a3hx, buttpark 45\01-04, benzamide, 2-chloro-5-fluoro, 2-chloranyl-5-fluoranyl-benzamide, 3-carbamoyl-4-chloro-1-fluorobenzene PubChem CID: 2773590 IUPAC Name: 2-chloro-5-fluorobenzamide SMILES: C1=CC(=C(C=C1F)C(=O)N)Cl

Alfa Aesar™ Methyl 2-amino-5-bromobenzoate, 98%

CAS: 52727-57-8 Fórmula molecular: C8H8BrNO2 Molecular Weight (g/mol): 230.061 Número MDL: MFCD00144761 InChI Key: QVNYNHCNNGKULA-UHFFFAOYSA-N Sinónimo: methyl 5-bromoanthranilate, 2-amino-5-bromobenzoic acid methyl ester, 5-bromoanthranilic acid methyl ester, 2-amino-5-bromo-benzoic acid methyl ester, methyl 5-bromo-2-aminobenzoate, benzoic acid, 2-amino-5-bromo-, methyl ester, benzoic acid, 2-amino-5-bromo-, methyl ester, hydrochloride, pubchem3344, methyl-5-bromoanthranilate, acmc-1ats7 PubChem CID: 736224 IUPAC Name: methyl 2-amino-5-bromobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)Br)N

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

CAS: 933585-20-7 Fórmula molecular: C7H5BrFNO Molecular Weight (g/mol): 218.025 Número MDL: 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™ 3-Bromo-5-(trifluoromethoxy)benzamide, 97%

CAS: 914636-32-1 Fórmula molecular: C8H5BrF3NO2 Molecular Weight (g/mol): 284.032 Número MDL: MFCD08458075 InChI Key: PIHJYRPSTBFOOV-UHFFFAOYSA-N Sinónimo: 3-bromo-5-trifluoromethoxy benzamide PubChem CID: 26985420 IUPAC Name: 3-bromo-5-(trifluoromethoxy)benzamide SMILES: C1=C(C=C(C=C1OC(F)(F)F)Br)C(=O)N

Alfa Aesar™ 3-Bromo-5-iodobenzoic acid, 97%

CAS: 188815-32-9 Fórmula molecular: C7H4BrIO2 Molecular Weight (g/mol): 326.915 Número MDL: MFCD00191851 InChI Key: MKJBJYCBKXPQSY-UHFFFAOYSA-N Sinónimo: 5-bromo-3-iodobenzoic acid, 3-bromo-5-iodo-benzoic acid, 3-bromo-5-iodobenzoicacid, benzoic acid, 3-bromo-5-iodo, 3-iodo-5-bromobenzoic acid, pubchem3788, acmc-209erv, 3-bromo-5-iodobenzoic aicd, 3-bromo-5-iodo benzoic acid, 5-iodo-3-bromo-benzoic acid PubChem CID: 5182520 IUPAC Name: 3-bromo-5-iodobenzoic acid SMILES: C1=C(C=C(C=C1Br)I)C(=O)O

Alfa Aesar™ 2-Chloro-4-(1-pyrrolidinylcarbonyl)benzeneboronic acid, 97%

CAS: 1449131-93-4 Fórmula molecular: C11H13BClNO3 Molecular Weight (g/mol): 253.489 Número MDL: MFCD22125137 InChI Key: CCPHBMWIZPSWRQ-UHFFFAOYSA-N Sinónimo: 2-chloro-4-1-pyrrolidinylcarbonyl phenylboronic acid, 2-chloro-4-1-pyrrolidinylcarbonyl benzeneboronic acid, 2-chloro-4-pyrrolidine-1-carbonyl phenylboronic acid, 2-chloro-4-pyrrolidine-1-carbonyl phenyl boronic acid PubChem CID: 73996117 IUPAC Name: [2-chloro-4-(pyrrolidine-1-carbonyl)phenyl]boronic acid SMILES: B(C1=C(C=C(C=C1)C(=O)N2CCCC2)Cl)(O)O

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

CAS: 350-28-7 Fórmula molecular: C8H7FO2 Molecular Weight (g/mol): 154.14 Número MDL: MFCD00002490 InChI Key: XUQCONCMPCVUDM-UHFFFAOYSA-N Sinónimo: 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™ Ethyl 2-amino-5-iodobenzoate, 98+%

CAS: 268568-11-2 Fórmula molecular: C9H10INO2 Molecular Weight (g/mol): 291.088 Número MDL: MFCD04038940 InChI Key: FPCLHSGOJPEKKE-UHFFFAOYSA-N Sinónimo: ethyl2-amino-5-iodobenzoate, 2-amino-5-iodobenzoic acid ethyl ester, 2-amino-5-iodo-benzoic acid ethyl ester, acmc-1cksm, ethyl 2-amino-5-iodo-benzoate, ethyl 5-iodoanthranilate PubChem CID: 12012179 IUPAC Name: ethyl 2-amino-5-iodobenzoate SMILES: CCOC(=O)C1=C(C=CC(=C1)I)N

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

CAS: 1449133-18-9 Fórmula molecular: C13H9BClFN2O5 Molecular Weight (g/mol): 338.482 Número MDL: MFCD20126195 InChI Key: SMRJKQIAHFDGKT-UHFFFAOYSA-N Sinónimo: 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

3-Bromo-2-methylbenzoic acid, 97%, ACROS Organics™

CAS: 76006-33-2 Fórmula molecular: C8H7BrO2 Molecular Weight (g/mol): 215.05 Número MDL: MFCD00270097 InChI Key: BJGKVCKGUBYULR-UHFFFAOYSA-N Sinónimo: 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™ 3,5-Dichlorobenzhydrazide, 97%

CAS: 62899-78-9 Fórmula molecular: C7H6Cl2N2O Molecular Weight (g/mol): 205.038 Número MDL: MFCD00833411 InChI Key: DNISXKBKTSHNKL-UHFFFAOYSA-N Sinónimo: 3,5-dichlorobenzhydrazide, 3,5-dichlorobenzenecarbohydrazide, acmc-1b4zh, 3,5-bis chloranyl benzohydrazide, 3,5-dichlorobenzoic acid hydrazide, benzoic acid,3,5-dichloro-,hydrazide, benzoic acid,3,5-dichloro-, hydrazide PubChem CID: 2735966 IUPAC Name: 3,5-dichlorobenzohydrazide SMILES: C1=C(C=C(C=C1Cl)Cl)C(=O)NN

Alfa Aesar™ 2,5-Dichlorobenzhydrazide, 98+%

CAS: 67487-35-8 Fórmula molecular: C7H6Cl2N2O Molecular Weight (g/mol): 205.038 Número MDL: MFCD00014754 InChI Key: XECBCXNWGBDIMG-UHFFFAOYSA-N Sinónimo: 2,5-dichlorobenzhydrazide, 1,4-dichlorobenzene-2-carbohydrazide, #, 2,5-dichlorobenzoic hydrazide, 2,5-bis chloranyl benzohydrazide, labotest-bb lt00454263, labotest-bb lt03497761, 2,5-dichlorobenzoic acid hydrazide PubChem CID: 144246 IUPAC Name: 2,5-dichlorobenzohydrazide SMILES: C1=CC(=C(C=C1Cl)C(=O)NN)Cl

Alfa Aesar™ 2,5-Dichlorobenzamide, 97%

CAS: 5980-26-7 Fórmula molecular: C7H5Cl2NO Molecular Weight (g/mol): 190.023 Número MDL: MFCD00017609 InChI Key: NMHJIYQWKWHDSX-UHFFFAOYSA-N Sinónimo: benzamide, 2,5-dichloro, 2,5-dichloro-benzamide, benzamide,2,5-dichloro, acmc-209w3r, ksc610k1t PubChem CID: 22290 IUPAC Name: 2,5-dichlorobenzamide SMILES: C1=CC(=C(C=C1Cl)C(=O)N)Cl

3,5-dibromobenzamide, Maybridge™

CAS: 175205-85-3 Fórmula molecular: C7H5Br2NO Molecular Weight (g/mol): 278.931 InChI Key: IOFGMNBDIDEBIQ-UHFFFAOYSA-N Sinónimo: 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™ 3-Chloro-N-(4-methoxyphenyl)benzamide, 97%

CAS: 158525-81-6 Fórmula molecular: C14H12ClNO2 Molecular Weight (g/mol): 261.705 Número MDL: MFCD01033999 InChI Key: OASYJKCQPDJQQR-UHFFFAOYSA-N Sinónimo: 3-chloro-n-4-methoxyphenyl benzamide, cbmicro_012214, 3-chloro-n~1~-4-methoxyphenyl benzamide, 3-chlorophenyl-n-4-methoxyphenyl carboxamide PubChem CID: 835440 IUPAC Name: 3-chloro-N-(4-methoxyphenyl)benzamide SMILES: COC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)Cl

Alfa Aesar™ 3-Chlorobenzoyl chloride, 97%

CAS: 618-46-2 Fórmula molecular: C7H4Cl2O Molecular Weight (g/mol): 175.008 Número MDL: MFCD00000671 InChI Key: WHIHIKVIWVIIER-UHFFFAOYSA-N Sinónimo: m-chlorobenzoyl chloride, benzoyl chloride, 3-chloro, benzoyl chloride, m-chloro, m-chlorobenzoylchloride, 3-chlorobenzoylchloride, benzoylchloride, 3-chloro, mcoc, 3-chlorobenzoic acid chloride, ccris 8615, 3chlorobenzoyl chloride PubChem CID: 69252 IUPAC Name: 3-chlorobenzoyl chloride SMILES: C1=CC(=CC(=C1)Cl)C(=O)Cl

Alfa Aesar™ Ethyl pentafluorobenzoate, 98%

CAS: 4522-93-4 Fórmula molecular: C9H5F5O2 Molecular Weight (g/mol): 240.129 Número MDL: MFCD00039211 InChI Key: DFUDMSIRGGTHGI-UHFFFAOYSA-N Sinónimo: 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

Alfa Aesar™ 3-Fluoro-5-methylbenzoic acid, 97%

CAS: 518070-19-4 Fórmula molecular: C8H7FO2 Molecular Weight (g/mol): 154.14 Número MDL: MFCD03094313 InChI Key: XPUFVYIUPYNLPD-UHFFFAOYSA-N Sinónimo: 3-fluoro-5-methylbenzoicacid, 3-fluoro-5-methyl-benzoic acid, benzoic acid, 3-fluoro-5-methyl, pubchem1396, 3-carboxy-5-fluorotoluene, acmc-1b05f, ksc498a8l, 3-fluoro-5-methybenzoic acid, rarechem al bo 2238, 3-fluoro-5-methyl benzoic acid PubChem CID: 2778447 IUPAC Name: 3-fluoro-5-methylbenzoic acid SMILES: CC1=CC(=CC(=C1)C(=O)O)F

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

CAS: 59189-97-8 Fórmula molecular: C8H6ClFO Molecular Weight (g/mol): 172.583 Número MDL: MFCD00671774 InChI Key: DPWCZSXNEGNALT-UHFFFAOYSA-N Sinónimo: 3-fluoro-4-methyl-benzoyl chloride, 3-fluoro-4-methylbenzoylchloride, acmc-20an3p, 3-fluoro-4-methyl-benzoylchloride, 3-fluoro-4-methyl benzoyl chloride, benzoyl chloride,3-fluoro-4-methyl, 3-fluoranyl-4-methyl-benzoyl chloride, benzoyl chloride, 3-fluoro-4-methyl, 3-fluoro-4-methylbenzoyl chloride, benzoyl chloride, 3-fluoro-4-methyl-9ci PubChem CID: 2734875 IUPAC Name: 3-fluoro-4-methylbenzoyl chloride SMILES: CC1=C(C=C(C=C1)C(=O)Cl)F

Alfa Aesar™ 3-Chlorobenzoic acid, 99%

CAS: 535-80-8 Fórmula molecular: C7H5ClO2 Molecular Weight (g/mol): 156.565 Número MDL: MFCD00002491 InChI Key: LULAYUGMBFYYEX-UHFFFAOYSA-N Sinónimo: m-chlorobenzoic acid, benzoic acid, 3-chloro, benzoic acid, m-chloro, 3-chlorobenzoicacid, 3-chloro-benzoic acid, m-chlorobenzoate, acido m-clorobenzoico, unii-02uoj7064k, mcba, ccris 5992 PubChem CID: 447 ChEBI: CHEBI:49410 IUPAC Name: 3-chlorobenzoic acid SMILES: C1=CC(=CC(=C1)Cl)C(=O)O

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

CAS: 871332-63-7 Fórmula molecular: C8H9BFNO3 Molecular Weight (g/mol): 196.972 Número MDL: MFCD07363793 InChI Key: CDJLVNMKXZMCHU-UHFFFAOYSA-N Sinónimo: 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-Dichlorobenzamide, 97%

CAS: 5980-23-4 Fórmula molecular: C7H5Cl2NO Molecular Weight (g/mol): 190.023 Número MDL: MFCD00057644 InChI Key: DELNZTRPJTUOIP-UHFFFAOYSA-N Sinónimo: benzamide,3,5-dichloro, benzamide, 3,5-dichloro, 3,5-dichloro-benzamide, acmc-1b12b, 3,5-bis chloranyl benzamide, 3,5-dichloro benzamide PubChem CID: 22289 IUPAC Name: 3,5-dichlorobenzamide SMILES: C1=C(C=C(C=C1Cl)Cl)C(=O)N

Alfa Aesar™ 3-Bromobenzhydrazide, 98+%

CAS: 39115-96-3 Fórmula molecular: C7H7BrN2O Molecular Weight (g/mol): 215.05 Número MDL: MFCD00007600 InChI Key: BNAQRAZIPAHWAR-UHFFFAOYSA-N Sinónimo: 3-bromobenzhydrazide, m-bromobenzohydrazide, 3-bromobenzoic hydrazide, benzoic acid, 3-bromo-, hydrazide, 3-bromobenzoic acid hydrazide, 3-bromobenzoylhydrazine, benzoylhydrazine, m-bromo, 3-bromo-benzoic acid hydrazide, 3-bromobenzenecarbohydrazide, 3-bromanylbenzohydrazide PubChem CID: 520941 IUPAC Name: 3-bromobenzohydrazide SMILES: C1=CC(=CC(=C1)Br)C(=O)NN

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

CAS: 25026-64-6 Fórmula molecular: C7H4ClFO2 Molecular Weight (g/mol): 174.555 Número MDL: MFCD00973904 InChI Key: QFMRANWPGGSNHS-UHFFFAOYSA-N Sinónimo: 3-chloro-5-fluoro-benzoic acid, 3-fluoro-5-chlorobenzoic acid, 5-chloro-3-fluorobenzoic acid, benzoic acid, 3-chloro-5-fluoro, 3-chloro-5-fluorobenzoicacid, pubchem1373, acmc-209ggm, intermediates-zcf02673, ksc497i9n, rarechem al be 1247 PubChem CID: 2734840 IUPAC Name: 3-chloro-5-fluorobenzoic acid SMILES: C1=C(C=C(C=C1F)Cl)C(=O)O

Alfa Aesar™ 5-Fluoro-2-(trifluoromethoxy)benzoyl chloride, 97%

CAS: 1092460-84-8 Fórmula molecular: C8H3ClF4O2 Molecular Weight (g/mol): 242.554 Número MDL: MFCD11519334 InChI Key: ZZRULKQBGZXHPC-UHFFFAOYSA-N Sinónimo: 5-fluoro-2-trifluoromethoxy benzoyl chloride, 5-fluoro-2-trifluoromethoxy benzoyl chloride, jrd PubChem CID: 57364110 IUPAC Name: 5-fluoro-2-(trifluoromethoxy)benzoyl chloride SMILES: C1=CC(=C(C=C1F)C(=O)Cl)OC(F)(F)F

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

CAS: 2905-62-6 Fórmula molecular: C7H3Cl3O Molecular Weight (g/mol): 209.45 Número MDL: MFCD00009817 InChI Key: GGHLXLVPNZMBQR-UHFFFAOYSA-N Sinónimo: 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

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