Benzenoids
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Methyl 4-Chlorobenzoate 98.0+%, TCI America™
CAS: 1126-46-1 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00000621 InChI Key: LXNFVVDCCWUUKC-UHFFFAOYSA-N Synonym: methyl p-chlorobenzoate,4-chlorobenzoic acid methyl ester,benzoic acid, 4-chloro-, methyl ester,unii-m0u80j80va,benzoic acid, p-chloro-, methyl ester,methyl-p-chlorobenzoate,p-chlorobenzoic acid methyl ester,methyl-4-chlorobenzoate,4-chloro-benzoic acid methyl ester,decitabine related compound d PubChem CID: 14307 IUPAC Name: methyl 4-chlorobenzoate SMILES: COC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 14307 |
|---|---|
| CAS | 1126-46-1 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00000621 |
| SMILES | COC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | methyl p-chlorobenzoate,4-chlorobenzoic acid methyl ester,benzoic acid, 4-chloro-, methyl ester,unii-m0u80j80va,benzoic acid, p-chloro-, methyl ester,methyl-p-chlorobenzoate,p-chlorobenzoic acid methyl ester,methyl-4-chlorobenzoate,4-chloro-benzoic acid methyl ester,decitabine related compound d |
| IUPAC Name | methyl 4-chlorobenzoate |
| InChI Key | LXNFVVDCCWUUKC-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
4-Bromophthalic Acid 98.0+%, TCI America™
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
| PubChem CID | 81428 |
|---|---|
| CAS | 6968-28-1 |
| Molecular Weight (g/mol) | 245.028 |
| MDL Number | MFCD00043538 |
| SMILES | C1=CC(=C(C=C1Br)C(=O)O)C(=O)O |
| 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 |
| IUPAC Name | 4-bromophthalic acid |
| InChI Key | AZXKGUVDIORSED-UHFFFAOYSA-N |
| Molecular Formula | C8H5BrO4 |
4-Chloro-3-methylbenzoic Acid 98.0+%, TCI America™
CAS: 7697-29-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00045853 InChI Key: MRUKIIWRMSYKML-UHFFFAOYSA-N Synonym: 4-chloro-m-toluic acid,4-chloro-3-methyl-benzoic acid,4-chloro-3-methyl benzoic acid,benzoic acid, 4-chloro-3-methyl,m-toluic acid, 4-chloro,pubchem3666,5-carboxy-2-chlorotoluene,acmc-1bg77,ksc497q5r,4-chloranyl-3-methyl-benzoic acid PubChem CID: 282989 IUPAC Name: 4-chloro-3-methylbenzoic acid SMILES: CC1=CC(=CC=C1Cl)C(O)=O
| PubChem CID | 282989 |
|---|---|
| CAS | 7697-29-2 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00045853 |
| SMILES | CC1=CC(=CC=C1Cl)C(O)=O |
| Synonym | 4-chloro-m-toluic acid,4-chloro-3-methyl-benzoic acid,4-chloro-3-methyl benzoic acid,benzoic acid, 4-chloro-3-methyl,m-toluic acid, 4-chloro,pubchem3666,5-carboxy-2-chlorotoluene,acmc-1bg77,ksc497q5r,4-chloranyl-3-methyl-benzoic acid |
| IUPAC Name | 4-chloro-3-methylbenzoic acid |
| InChI Key | MRUKIIWRMSYKML-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
2-Iodobenzamide 98.0+%, TCI America™
CAS: 3930-83-4 Molecular Formula: C7H6INO Molecular Weight (g/mol): 247.035 MDL Number: MFCD00099248 InChI Key: YEOYYWCXWUDVCX-UHFFFAOYSA-N PubChem CID: 77529 IUPAC Name: 2-iodobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)I
| PubChem CID | 77529 |
|---|---|
| CAS | 3930-83-4 |
| Molecular Weight (g/mol) | 247.035 |
| MDL Number | MFCD00099248 |
| SMILES | C1=CC=C(C(=C1)C(=O)N)I |
| IUPAC Name | 2-iodobenzamide |
| InChI Key | YEOYYWCXWUDVCX-UHFFFAOYSA-N |
| Molecular Formula | C7H6INO |
3,4,5-Trifluorobenzoic Acid 98.0+%, TCI America™
CAS: 121602-93-5 Molecular Formula: C7H3F3O2 Molecular Weight (g/mol): 176.094 MDL Number: MFCD00074962 InChI Key: VJMYKESYFHYUEQ-UHFFFAOYSA-N Synonym: 3,4,5-trifluorobenzoicacid,benzoic acid, 3,4,5-trifluoro,3,4,5-trifluoro benzoic acid,3,4,5-trifluoro-benzoic acid,acmc-209aen,ksc177i9t,rarechem al bo 0682,3,4,5-trifluorobenzoyl alcohol,buttpark 30\01-46 PubChem CID: 853154 IUPAC Name: 3,4,5-trifluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)F)F)C(=O)O
| PubChem CID | 853154 |
|---|---|
| CAS | 121602-93-5 |
| Molecular Weight (g/mol) | 176.094 |
| MDL Number | MFCD00074962 |
| SMILES | C1=C(C=C(C(=C1F)F)F)C(=O)O |
| Synonym | 3,4,5-trifluorobenzoicacid,benzoic acid, 3,4,5-trifluoro,3,4,5-trifluoro benzoic acid,3,4,5-trifluoro-benzoic acid,acmc-209aen,ksc177i9t,rarechem al bo 0682,3,4,5-trifluorobenzoyl alcohol,buttpark 30\01-46 |
| IUPAC Name | 3,4,5-trifluorobenzoic acid |
| InChI Key | VJMYKESYFHYUEQ-UHFFFAOYSA-N |
| Molecular Formula | C7H3F3O2 |
2,3-Dichlorobenzoyl Chloride 98.0+%, TCI America™
CAS: 2905-60-4 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00035937 InChI Key: YBONBWJSFMTXLE-UHFFFAOYSA-N Synonym: benzoyl chloride, dichloro,dichlorobenzoyl chloride,benzoyl chloride, 2,3-dichloro,unii-i50f21ps1n,2,3-dichlorobenzoylchloride,acmc-1cfin,2,3-dichlorobenzoyl-chloride,ksc202s8t,2, 3-dichlorobenzoyl chloride,2,3-dcoc PubChem CID: 17944 IUPAC Name: 2,3-dichlorobenzoyl chloride SMILES: ClC(=O)C1=CC=CC(Cl)=C1Cl
| PubChem CID | 17944 |
|---|---|
| CAS | 2905-60-4 |
| Molecular Weight (g/mol) | 209.45 |
| MDL Number | MFCD00035937 |
| SMILES | ClC(=O)C1=CC=CC(Cl)=C1Cl |
| Synonym | benzoyl chloride, dichloro,dichlorobenzoyl chloride,benzoyl chloride, 2,3-dichloro,unii-i50f21ps1n,2,3-dichlorobenzoylchloride,acmc-1cfin,2,3-dichlorobenzoyl-chloride,ksc202s8t,2, 3-dichlorobenzoyl chloride,2,3-dcoc |
| IUPAC Name | 2,3-dichlorobenzoyl chloride |
| InChI Key | YBONBWJSFMTXLE-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl3O |
2-Fluoro-5-iodobenzoic Acid 98.0+%, TCI America™
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
| PubChem CID | 2778925 |
|---|---|
| CAS | 124700-41-0 |
| Molecular Weight (g/mol) | 266.01 |
| MDL Number | MFCD03094517 |
| SMILES | C1=CC(=C(C=C1I)C(=O)O)F |
| 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 |
| IUPAC Name | 2-fluoro-5-iodobenzoic acid |
| InChI Key | QNNJHBNTHVHALE-UHFFFAOYSA-N |
| Molecular Formula | C7H4FIO2 |
2,4-Difluorobenzoic Acid 98.0+%, TCI America™
CAS: 1583-58-0 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD00011670 InChI Key: NJYBIFYEWYWYAN-UHFFFAOYSA-N Synonym: 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid PubChem CID: 74102 IUPAC Name: 2,4-difluorobenzoic acid SMILES: OC(=O)C1=CC=C(F)C=C1F
| PubChem CID | 74102 |
|---|---|
| CAS | 1583-58-0 |
| Molecular Weight (g/mol) | 158.10 |
| MDL Number | MFCD00011670 |
| SMILES | OC(=O)C1=CC=C(F)C=C1F |
| Synonym | 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid |
| IUPAC Name | 2,4-difluorobenzoic acid |
| InChI Key | NJYBIFYEWYWYAN-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O2 |
3,4-Difluorobenzoic Acid 98.0+%, TCI America™
CAS: 455-86-7 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.104 MDL Number: MFCD00011672 InChI Key: FPENCTDAQQQKNY-UHFFFAOYSA-N Synonym: benzoic acid, 3,4-difluoro,3,4-fifluorobenzoic acid,3,4-difluoro-benzoic acid,3,4-dichloropnenol,pubchem1337,acmc-209k3h,3,4-difluoro benzoic acid,ksc237g8t,rarechem al bo 0269,timtec-bb sbb006721 PubChem CID: 99166 IUPAC Name: 3,4-difluorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)F
| PubChem CID | 99166 |
|---|---|
| CAS | 455-86-7 |
| Molecular Weight (g/mol) | 158.104 |
| MDL Number | MFCD00011672 |
| SMILES | C1=CC(=C(C=C1C(=O)O)F)F |
| Synonym | benzoic acid, 3,4-difluoro,3,4-fifluorobenzoic acid,3,4-difluoro-benzoic acid,3,4-dichloropnenol,pubchem1337,acmc-209k3h,3,4-difluoro benzoic acid,ksc237g8t,rarechem al bo 0269,timtec-bb sbb006721 |
| IUPAC Name | 3,4-difluorobenzoic acid |
| InChI Key | FPENCTDAQQQKNY-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O2 |
3,5-Di-tert-butylsalicylic Acid 95.0+%, TCI America™
CAS: 19715-19-6 Molecular Formula: C15H22O3 Molecular Weight (g/mol): 250.338 MDL Number: MFCD00059058 InChI Key: ZWQBZEFLFSFEOS-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-2-hydroxybenzoic acid,3,5-bis-tert-butylsalicylic acid,3,5-di-tert-butylsalicylic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl hydroxy,benzoic acid, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-ditertbutyl salicylic acid,dibutylsalicylicacid,acmc-1c7qv,3,2-bis 1,1-dimethylethyl-2-hydroxybenzoic acid,ksc466o9n PubChem CID: 88208 IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzoic acid SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C
| PubChem CID | 88208 |
|---|---|
| CAS | 19715-19-6 |
| Molecular Weight (g/mol) | 250.338 |
| MDL Number | MFCD00059058 |
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C |
| Synonym | 3,5-di-tert-butyl-2-hydroxybenzoic acid,3,5-bis-tert-butylsalicylic acid,3,5-di-tert-butylsalicylic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl hydroxy,benzoic acid, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-ditertbutyl salicylic acid,dibutylsalicylicacid,acmc-1c7qv,3,2-bis 1,1-dimethylethyl-2-hydroxybenzoic acid,ksc466o9n |
| IUPAC Name | 3,5-ditert-butyl-2-hydroxybenzoic acid |
| InChI Key | ZWQBZEFLFSFEOS-UHFFFAOYSA-N |
| Molecular Formula | C15H22O3 |
3-Iodo-p-toluic Acid 98.0+%, TCI America™
CAS: 82998-57-0 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD00010392 InChI Key: LDDHMKANNXWUAK-UHFFFAOYSA-N Synonym: 3-iodo-4-methyl-benzoic acid,benzoic acid, 3-iodo-4-methyl,zlchem 953,3-iodo-p-toluicacid,pubchem3947,4-carboxy-2-iodotoluene,akos bbb/227,ksc449e9t,3-iodo-4-methyl benzoic acid,paragos 440021 PubChem CID: 621640 IUPAC Name: 3-iodo-4-methylbenzoic acid SMILES: CC1=C(C=C(C=C1)C(=O)O)I
| PubChem CID | 621640 |
|---|---|
| CAS | 82998-57-0 |
| Molecular Weight (g/mol) | 262.046 |
| MDL Number | MFCD00010392 |
| SMILES | CC1=C(C=C(C=C1)C(=O)O)I |
| Synonym | 3-iodo-4-methyl-benzoic acid,benzoic acid, 3-iodo-4-methyl,zlchem 953,3-iodo-p-toluicacid,pubchem3947,4-carboxy-2-iodotoluene,akos bbb/227,ksc449e9t,3-iodo-4-methyl benzoic acid,paragos 440021 |
| IUPAC Name | 3-iodo-4-methylbenzoic acid |
| InChI Key | LDDHMKANNXWUAK-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO2 |
Ethyl 3-Bromobenzoate 98.0+%, TCI America™
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
| PubChem CID | 90488 |
|---|---|
| CAS | 24398-88-7 |
| Molecular Weight (g/mol) | 229.073 |
| MDL Number | MFCD00013529 |
| SMILES | CCOC(=O)C1=CC(=CC=C1)Br |
| 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 |
| IUPAC Name | ethyl 3-bromobenzoate |
| InChI Key | QAUASTLEZAPQTB-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
3-Fluorosalicylic Acid 98.0+%, TCI America™
CAS: 341-27-5 Molecular Formula: C7H5FO3 Molecular Weight (g/mol): 156.112 MDL Number: MFCD00153167 InChI Key: GFHCXVJXSLGRJR-UHFFFAOYSA-N Synonym: 3-fluorosalicylic acid,benzoic acid, 3-fluoro-2-hydroxy,2-hydroxy-3-fluorobenzoic acid,3-fluoro-2-hydroxy-benzoic acid,salicylic acid, 3-fluoro,2-hydroxy-3-fluorobenzoicacid,3-fluoro-2-hydroxybenzoicacid,pubchem4960,acmc-1cjoo PubChem CID: 268724 IUPAC Name: 3-fluoro-2-hydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)F)O)C(=O)O
| PubChem CID | 268724 |
|---|---|
| CAS | 341-27-5 |
| Molecular Weight (g/mol) | 156.112 |
| MDL Number | MFCD00153167 |
| SMILES | C1=CC(=C(C(=C1)F)O)C(=O)O |
| Synonym | 3-fluorosalicylic acid,benzoic acid, 3-fluoro-2-hydroxy,2-hydroxy-3-fluorobenzoic acid,3-fluoro-2-hydroxy-benzoic acid,salicylic acid, 3-fluoro,2-hydroxy-3-fluorobenzoicacid,3-fluoro-2-hydroxybenzoicacid,pubchem4960,acmc-1cjoo |
| IUPAC Name | 3-fluoro-2-hydroxybenzoic acid |
| InChI Key | GFHCXVJXSLGRJR-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO3 |
3,4-Dichlorobenzoyl Chloride 98.0+%, TCI America™
CAS: 3024-72-4 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00000672 InChI Key: VTXNOVCTHUBABW-UHFFFAOYSA-N Synonym: benzoyl chloride, 3,4-dichloro,3,4-dichlorobenzoylchloride,3,4-dichloro benzoyl chloride,2,3-dichlorobenzoyl,3,4dichlorobenzoyl chloride,acmc-1aj45,3,4 dichlorobenzoyl chloride,3,4-dichlorobenzoyl-chloride,ksc225o5d,3,4-dichloro-benzoyl chloride PubChem CID: 76403 IUPAC Name: 3,4-dichlorobenzoyl chloride SMILES: C1=CC(=C(C=C1C(=O)Cl)Cl)Cl
| PubChem CID | 76403 |
|---|---|
| CAS | 3024-72-4 |
| Molecular Weight (g/mol) | 209.45 |
| MDL Number | MFCD00000672 |
| SMILES | C1=CC(=C(C=C1C(=O)Cl)Cl)Cl |
| Synonym | benzoyl chloride, 3,4-dichloro,3,4-dichlorobenzoylchloride,3,4-dichloro benzoyl chloride,2,3-dichlorobenzoyl,3,4dichlorobenzoyl chloride,acmc-1aj45,3,4 dichlorobenzoyl chloride,3,4-dichlorobenzoyl-chloride,ksc225o5d,3,4-dichloro-benzoyl chloride |
| IUPAC Name | 3,4-dichlorobenzoyl chloride |
| InChI Key | VTXNOVCTHUBABW-UHFFFAOYSA-N |
| Molecular Formula | C7H3Cl3O |
2-Fluoro-3-methylbenzoic Acid 98.0+%, TCI America™
CAS: 315-31-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00042504 InChI Key: DGNAETGARNTCIL-UHFFFAOYSA-N Synonym: 2-fluoro-m-toluic acid,2-fluoro-3-methylbenzoicacid,benzoic acid, 2-fluoro-3-methyl,2-fluoro-3-methyl-benzoic acid,maybridge1_003142,pubchem1328,fluoro-3-methylbenzoic acid,ksc222a8b,3-methyl-2-fluorobenzoic acid,2-fluoro-3-methyl benzoic acid PubChem CID: 2737379 IUPAC Name: 2-fluoro-3-methylbenzoic acid SMILES: CC1=CC=CC(C(O)=O)=C1F
| PubChem CID | 2737379 |
|---|---|
| CAS | 315-31-1 |
| Molecular Weight (g/mol) | 154.14 |
| MDL Number | MFCD00042504 |
| SMILES | CC1=CC=CC(C(O)=O)=C1F |
| Synonym | 2-fluoro-m-toluic acid,2-fluoro-3-methylbenzoicacid,benzoic acid, 2-fluoro-3-methyl,2-fluoro-3-methyl-benzoic acid,maybridge1_003142,pubchem1328,fluoro-3-methylbenzoic acid,ksc222a8b,3-methyl-2-fluorobenzoic acid,2-fluoro-3-methyl benzoic acid |
| IUPAC Name | 2-fluoro-3-methylbenzoic acid |
| InChI Key | DGNAETGARNTCIL-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO2 |