Benzene and substituted derivatives
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Ethyl 5-Bromo-2-chlorobenzoate 98.0+%, TCI America™
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
| PubChem CID | 144749 |
|---|---|
| CAS | 76008-73-6 |
| Molecular Weight (g/mol) | 263.515 |
| MDL Number | MFCD00013635 |
| SMILES | CCOC(=O)C1=C(C=CC(=C1)Br)Cl |
| 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 |
| IUPAC Name | ethyl 5-bromo-2-chlorobenzoate |
| InChI Key | AMGWDYLEMSMUIO-UHFFFAOYSA-N |
| Molecular Formula | C9H8BrClO2 |
5-Chloro-2-nitrobenzamide 90.0+%, TCI America™
CAS: 40763-96-0 Molecular Formula: C7H5ClN2O3 Molecular Weight (g/mol): 200.578 InChI Key: MKHXTOPPKVFSFI-UHFFFAOYSA-N Synonym: benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide PubChem CID: 2723672 IUPAC Name: 5-chloro-2-nitrobenzamide SMILES: C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-]
| PubChem CID | 2723672 |
|---|---|
| CAS | 40763-96-0 |
| Molecular Weight (g/mol) | 200.578 |
| SMILES | C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-] |
| Synonym | benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide |
| IUPAC Name | 5-chloro-2-nitrobenzamide |
| InChI Key | MKHXTOPPKVFSFI-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClN2O3 |
3-Chloro-2,4-difluorobenzoic Acid 98.0+%, TCI America™
CAS: 154257-75-7 Molecular Formula: C7H2ClF2O2 Molecular Weight (g/mol): 191.54 MDL Number: MFCD01631387 InChI Key: YGYZTZAEZMCPSC-UHFFFAOYSA-M 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-difluorobenzoate SMILES: [O-]C(=O)C1=CC=C(F)C(Cl)=C1F
| PubChem CID | 2773532 |
|---|---|
| CAS | 154257-75-7 |
| Molecular Weight (g/mol) | 191.54 |
| MDL Number | MFCD01631387 |
| SMILES | [O-]C(=O)C1=CC=C(F)C(Cl)=C1F |
| 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 |
| IUPAC Name | 3-chloro-2,4-difluorobenzoate |
| InChI Key | YGYZTZAEZMCPSC-UHFFFAOYSA-M |
| Molecular Formula | C7H2ClF2O2 |
Methyl 2-Chloro-4-fluorobenzoate 98.0+%, TCI America™
CAS: 85953-29-3 Molecular Formula: C8H6ClFO2 Molecular Weight (g/mol): 188.582 MDL Number: MFCD00173937 InChI Key: YZDLPZNWBRBZMZ-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate PubChem CID: 2763551 IUPAC Name: methyl 2-chloro-4-fluorobenzoate SMILES: COC(=O)C1=C(C=C(C=C1)F)Cl
| PubChem CID | 2763551 |
|---|---|
| CAS | 85953-29-3 |
| Molecular Weight (g/mol) | 188.582 |
| MDL Number | MFCD00173937 |
| SMILES | COC(=O)C1=C(C=C(C=C1)F)Cl |
| Synonym | 2-chloro-4-fluorobenzoic acid methyl ester,methyl 2-chloro-4-fluorobenzenecarboxylate,benzoic acid, 2-chloro-4-fluoro-, methyl ester,2-chloro-4-fluoro-benzoic acid methyl ester,pubchem18760,rarechem al bf 0289,acmc-209q7x,ksc495c1p,methyl 2-chloro-4-fluorob...,methy 2-chloro-4-fluorobenzoate |
| IUPAC Name | methyl 2-chloro-4-fluorobenzoate |
| InChI Key | YZDLPZNWBRBZMZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO2 |
3-Bromo-2-methylbenzoic Acid 98.0+%, TCI America™
CAS: 76006-33-2 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00270097 InChI Key: BJGKVCKGUBYULR-UHFFFAOYSA-N Synonym: 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
| PubChem CID | 2735590 |
|---|---|
| CAS | 76006-33-2 |
| Molecular Weight (g/mol) | 215.05 |
| MDL Number | MFCD00270097 |
| SMILES | CC1=C(C=CC=C1Br)C(O)=O |
| Synonym | 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 |
| IUPAC Name | 3-bromo-2-methylbenzoic acid |
| InChI Key | BJGKVCKGUBYULR-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
Propyzamide 96.0+%, TCI America™
CAS: 23950-58-5 Molecular Formula: C12H11Cl2NO Molecular Weight (g/mol): 256.126 MDL Number: MFCD00055346 InChI Key: PHNUZKMIPFFYSO-UHFFFAOYSA-N Synonym: propyzamide,pronamide,3,5-dichloro-n-1,1-dimethylpropynyl benzamide,3,5-dichloro-n-2-methylbut-3-yn-2-yl benzamide,kerb,pronamid,clanex,3,5-dichloro-n-1,1-dimethyl-2-propynyl benzamide,kerb 50w,caswell no. 306a PubChem CID: 32154 ChEBI: CHEBI:34935 IUPAC Name: 3,5-dichloro-N-(2-methylbut-3-yn-2-yl)benzamide SMILES: CC(C)(C#C)NC(=O)C1=CC(=CC(=C1)Cl)Cl
| PubChem CID | 32154 |
|---|---|
| CAS | 23950-58-5 |
| Molecular Weight (g/mol) | 256.126 |
| ChEBI | CHEBI:34935 |
| MDL Number | MFCD00055346 |
| SMILES | CC(C)(C#C)NC(=O)C1=CC(=CC(=C1)Cl)Cl |
| Synonym | propyzamide,pronamide,3,5-dichloro-n-1,1-dimethylpropynyl benzamide,3,5-dichloro-n-2-methylbut-3-yn-2-yl benzamide,kerb,pronamid,clanex,3,5-dichloro-n-1,1-dimethyl-2-propynyl benzamide,kerb 50w,caswell no. 306a |
| IUPAC Name | 3,5-dichloro-N-(2-methylbut-3-yn-2-yl)benzamide |
| InChI Key | PHNUZKMIPFFYSO-UHFFFAOYSA-N |
| Molecular Formula | C12H11Cl2NO |
2,2'-Methylenebis[6-(1-methylcyclohexyl)-p-cresol] 95.0+%, TCI America™
CAS: 77-62-3 Molecular Formula: C29H40O2 Molecular Weight (g/mol): 420.64 MDL Number: MFCD00151797 InChI Key: PHXLONCQBNATSL-UHFFFAOYSA-N Synonym: 2,2'-methylenebis 6-1-methylcyclohexyl-p-cresol,ionox wsp,nonox wsp,bisalkofen mtsp,unii-7tir91vdi9,7tir91vdi9,p-cresol, 2,2'-methylenebis 6-1-methylcyclohexyl,2,2'-methylenebis 4-methyl-6-1-methylcyclohexyl phenol PubChem CID: 6486 IUPAC Name: 2-{[2-hydroxy-5-methyl-3-(1-methylcyclohexyl)phenyl]methyl}-4-methyl-6-(1-methylcyclohexyl)phenol SMILES: CC1=CC(=C(O)C(CC2=C(O)C(=CC(C)=C2)C2(C)CCCCC2)=C1)C1(C)CCCCC1
| PubChem CID | 6486 |
|---|---|
| CAS | 77-62-3 |
| Molecular Weight (g/mol) | 420.64 |
| MDL Number | MFCD00151797 |
| SMILES | CC1=CC(=C(O)C(CC2=C(O)C(=CC(C)=C2)C2(C)CCCCC2)=C1)C1(C)CCCCC1 |
| Synonym | 2,2'-methylenebis 6-1-methylcyclohexyl-p-cresol,ionox wsp,nonox wsp,bisalkofen mtsp,unii-7tir91vdi9,7tir91vdi9,p-cresol, 2,2'-methylenebis 6-1-methylcyclohexyl,2,2'-methylenebis 4-methyl-6-1-methylcyclohexyl phenol |
| IUPAC Name | 2-{[2-hydroxy-5-methyl-3-(1-methylcyclohexyl)phenyl]methyl}-4-methyl-6-(1-methylcyclohexyl)phenol |
| InChI Key | PHXLONCQBNATSL-UHFFFAOYSA-N |
| Molecular Formula | C29H40O2 |
Ethyl 4-Acetamidophenylacetate 98.0+%, TCI America™
CAS: 13475-17-7 Molecular Formula: C12H15NO3 Molecular Weight (g/mol): 221.256 MDL Number: MFCD06797104 InChI Key: OOLUNZSKHFNSCD-UHFFFAOYSA-N Synonym: 4-Acetamidophenylacetic Acid Ethyl Ester PubChem CID: 10353455 IUPAC Name: ethyl 2-(4-acetamidophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)NC(=O)C
| PubChem CID | 10353455 |
|---|---|
| CAS | 13475-17-7 |
| Molecular Weight (g/mol) | 221.256 |
| MDL Number | MFCD06797104 |
| SMILES | CCOC(=O)CC1=CC=C(C=C1)NC(=O)C |
| Synonym | 4-Acetamidophenylacetic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-(4-acetamidophenyl)acetate |
| InChI Key | OOLUNZSKHFNSCD-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO3 |
4-Acetamidobenzaldehyde 98.0+%, TCI America™
CAS: 122-85-0 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00003380 InChI Key: SKLUWKYNZNXSLX-UHFFFAOYSA-N Synonym: 4-acetamidobenzaldehyde,n-4-formylphenyl acetamide,4-acetylaminobenzaldehyde,p-formylacetanilide,acetamide, n-4-formylphenyl,micotiazone,4-formylacetanilide,4'-formylacetanilide,p-acetamidobenzaldehyde,p-acetaminobenzaldehyde PubChem CID: 73942 IUPAC Name: N-(4-formylphenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)C=O
| PubChem CID | 73942 |
|---|---|
| CAS | 122-85-0 |
| Molecular Weight (g/mol) | 163.176 |
| MDL Number | MFCD00003380 |
| SMILES | CC(=O)NC1=CC=C(C=C1)C=O |
| Synonym | 4-acetamidobenzaldehyde,n-4-formylphenyl acetamide,4-acetylaminobenzaldehyde,p-formylacetanilide,acetamide, n-4-formylphenyl,micotiazone,4-formylacetanilide,4'-formylacetanilide,p-acetamidobenzaldehyde,p-acetaminobenzaldehyde |
| IUPAC Name | N-(4-formylphenyl)acetamide |
| InChI Key | SKLUWKYNZNXSLX-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO2 |
N-Phenylnicotinamide Hydrochloride 98.0+%, TCI America™
CAS: 69135-90-6 Molecular Formula: C12H11ClN2O Molecular Weight (g/mol): 234.683 MDL Number: MFCD00060194 InChI Key: SQFVWDGIESXVGY-UHFFFAOYSA-N Synonym: Nicotinanilide Hydrochloride PubChem CID: 23296855 IUPAC Name: N-phenylpyridine-3-carboxamide;hydrochloride SMILES: C1=CC=C(C=C1)NC(=O)C2=CN=CC=C2.Cl
| PubChem CID | 23296855 |
|---|---|
| CAS | 69135-90-6 |
| Molecular Weight (g/mol) | 234.683 |
| MDL Number | MFCD00060194 |
| SMILES | C1=CC=C(C=C1)NC(=O)C2=CN=CC=C2.Cl |
| Synonym | Nicotinanilide Hydrochloride |
| IUPAC Name | N-phenylpyridine-3-carboxamide;hydrochloride |
| InChI Key | SQFVWDGIESXVGY-UHFFFAOYSA-N |
| Molecular Formula | C12H11ClN2O |
p-Acetotoluidine 98.0+%, TCI America™
CAS: 103-89-9 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.193 MDL Number: MFCD00008677 InChI Key: YICAMJWHIUMFDI-UHFFFAOYSA-N Synonym: 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide PubChem CID: 7684 IUPAC Name: N-(4-methylphenyl)acetamide SMILES: CC1=CC=C(C=C1)NC(=O)C
| PubChem CID | 7684 |
|---|---|
| CAS | 103-89-9 |
| Molecular Weight (g/mol) | 149.193 |
| MDL Number | MFCD00008677 |
| SMILES | CC1=CC=C(C=C1)NC(=O)C |
| Synonym | 4'-methylacetanilide,p-acetotoluidide,n-4-methylphenyl acetamide,4-methylacetanilide,n-acetyl-p-toluidine,p-acetotoluide,acetyl-p-toluidine,p-acetotoluidine,acetamide, n-4-methylphenyl,4-acetotoluide |
| IUPAC Name | N-(4-methylphenyl)acetamide |
| InChI Key | YICAMJWHIUMFDI-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO |
2,2'-Methylenebis(6-bromo-4-chlorophenol) 95.0+%, TCI America™
CAS: 15435-29-7 Molecular Formula: C13H8Br2Cl2O2 Molecular Weight (g/mol): 426.91 MDL Number: MFCD00152965 InChI Key: TYBHZVUFOINFDV-UHFFFAOYSA-N Synonym: Bis(3-bromo-5-chloro-2-hydroxyphenyl)methane, 3,3′C-Dibromo-5,5′C-dichloro-2,2′C-dihydroxydiphenylmethane, Bromochlorophen PubChem CID: 84907 IUPAC Name: 2-bromo-6-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenol SMILES: OC1=C(Br)C=C(Cl)C=C1CC1=CC(Cl)=CC(Br)=C1O
| PubChem CID | 84907 |
|---|---|
| CAS | 15435-29-7 |
| Molecular Weight (g/mol) | 426.91 |
| MDL Number | MFCD00152965 |
| SMILES | OC1=C(Br)C=C(Cl)C=C1CC1=CC(Cl)=CC(Br)=C1O |
| Synonym | Bis(3-bromo-5-chloro-2-hydroxyphenyl)methane, 3,3′C-Dibromo-5,5′C-dichloro-2,2′C-dihydroxydiphenylmethane, Bromochlorophen |
| IUPAC Name | 2-bromo-6-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenol |
| InChI Key | TYBHZVUFOINFDV-UHFFFAOYSA-N |
| Molecular Formula | C13H8Br2Cl2O2 |
3',4'-Dimethylacetanilide 98.0+%, TCI America™
CAS: 2198-54-1 Molecular Formula: C10H13NO Molecular Weight (g/mol): 163.22 MDL Number: MFCD00026137 InChI Key: UAOIEEWQVAXCFY-UHFFFAOYSA-N Synonym: 3',4'-dimethylacetanilide,n-3,4-dimethylphenyl acetamide,3,4-dimethylacetanilide,n-acetyl-3,4-xylidine,3',4'-acetoxylidide,acetamide, n-3,4-dimethylphenyl,3',4'-acetoxylide,acetamide, n-3,4-dimethylphenyl-9ci,4-acetamino-o-xylol,aceto-3,4-xylidide PubChem CID: 75144 IUPAC Name: N-(3,4-dimethylphenyl)acetamide SMILES: CC1=C(C=C(C=C1)NC(=O)C)C
| PubChem CID | 75144 |
|---|---|
| CAS | 2198-54-1 |
| Molecular Weight (g/mol) | 163.22 |
| MDL Number | MFCD00026137 |
| SMILES | CC1=C(C=C(C=C1)NC(=O)C)C |
| Synonym | 3',4'-dimethylacetanilide,n-3,4-dimethylphenyl acetamide,3,4-dimethylacetanilide,n-acetyl-3,4-xylidine,3',4'-acetoxylidide,acetamide, n-3,4-dimethylphenyl,3',4'-acetoxylide,acetamide, n-3,4-dimethylphenyl-9ci,4-acetamino-o-xylol,aceto-3,4-xylidide |
| IUPAC Name | N-(3,4-dimethylphenyl)acetamide |
| InChI Key | UAOIEEWQVAXCFY-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO |
2,3,4,5-Tetrafluorobenzoyl Chloride 97.0+%, TCI America™
CAS: 94695-48-4 Molecular Formula: C7HClF4O Molecular Weight (g/mol): 212.53 MDL Number: MFCD00075164 InChI Key: XWCKIXLTBNGIHV-UHFFFAOYSA-N Synonym: 2,3,4,5-tetrafluorobenzoylchloride,tetrafluorobenzoyl chloride,2,3,4,5-tetrafluoro benzoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro,2,3,4,5-tetrafluorbenzoylchlorid,2,3,4,5-tetrafluoro-benzoyl chloride,2,3,4,5-tetrafluorobenzoic acid chloride,2,3,4,5-tetrafluorobezoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro-9ci,2,3,4,5-tetrafluorobezoylchloride PubChem CID: 2733689 IUPAC Name: 2,3,4,5-tetrafluorobenzoyl chloride SMILES: FC1=CC(C(Cl)=O)=C(F)C(F)=C1F
| PubChem CID | 2733689 |
|---|---|
| CAS | 94695-48-4 |
| Molecular Weight (g/mol) | 212.53 |
| MDL Number | MFCD00075164 |
| SMILES | FC1=CC(C(Cl)=O)=C(F)C(F)=C1F |
| Synonym | 2,3,4,5-tetrafluorobenzoylchloride,tetrafluorobenzoyl chloride,2,3,4,5-tetrafluoro benzoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro,2,3,4,5-tetrafluorbenzoylchlorid,2,3,4,5-tetrafluoro-benzoyl chloride,2,3,4,5-tetrafluorobenzoic acid chloride,2,3,4,5-tetrafluorobezoyl chloride,benzoyl chloride, 2,3,4,5-tetrafluoro-9ci,2,3,4,5-tetrafluorobezoylchloride |
| IUPAC Name | 2,3,4,5-tetrafluorobenzoyl chloride |
| InChI Key | XWCKIXLTBNGIHV-UHFFFAOYSA-N |
| Molecular Formula | C7HClF4O |
2-Iodobenzoyl Chloride 97.0+%, TCI America™
CAS: 609-67-6 Molecular Formula: C7H4ClIO Molecular Weight (g/mol): 266.462 MDL Number: MFCD00001040 InChI Key: MVIVDSWUOGNODP-UHFFFAOYSA-N PubChem CID: 69112 IUPAC Name: 2-iodobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)I
| PubChem CID | 69112 |
|---|---|
| CAS | 609-67-6 |
| Molecular Weight (g/mol) | 266.462 |
| MDL Number | MFCD00001040 |
| SMILES | C1=CC=C(C(=C1)C(=O)Cl)I |
| IUPAC Name | 2-iodobenzoyl chloride |
| InChI Key | MVIVDSWUOGNODP-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClIO |