Benzene and substituted derivatives
Filtered Search Results
Methyl Phenylsulfonylacetate 95.0+%, TCI America™
CAS: 34097-60-4 Molecular Formula: C9H10O4S Molecular Weight (g/mol): 214.235 MDL Number: MFCD00007555 InChI Key: NLEAIFBNKPYTGN-UHFFFAOYSA-N Synonym: methyl phenylsulfonylacetate,methyl 2-phenylsulfonyl acetate,methyl phenylsulfonyl acetate,methylphenylsulfonylacetate,benzenesulfonyl-acetic acid methyl ester,acmc-1ad0h,methyl benzenesulfonylacetate,methyl2-phenylsulfonyl acetate,methyl-phenylsulfonyl acetate PubChem CID: 555619 IUPAC Name: methyl 2-(benzenesulfonyl)acetate SMILES: COC(=O)CS(=O)(=O)C1=CC=CC=C1
| PubChem CID | 555619 |
|---|---|
| CAS | 34097-60-4 |
| Molecular Weight (g/mol) | 214.235 |
| MDL Number | MFCD00007555 |
| SMILES | COC(=O)CS(=O)(=O)C1=CC=CC=C1 |
| Synonym | methyl phenylsulfonylacetate,methyl 2-phenylsulfonyl acetate,methyl phenylsulfonyl acetate,methylphenylsulfonylacetate,benzenesulfonyl-acetic acid methyl ester,acmc-1ad0h,methyl benzenesulfonylacetate,methyl2-phenylsulfonyl acetate,methyl-phenylsulfonyl acetate |
| IUPAC Name | methyl 2-(benzenesulfonyl)acetate |
| InChI Key | NLEAIFBNKPYTGN-UHFFFAOYSA-N |
| Molecular Formula | C9H10O4S |
4'-Chlorobenzophenone-2-carboxylic Acid 98.0+%, TCI America™
CAS: 85-56-3 Molecular Formula: C14H9ClO3 Molecular Weight (g/mol): 260.673 MDL Number: MFCD00002474 InChI Key: YWECCEXWKFHHQJ-UHFFFAOYSA-N Synonym: 2-4-chlorobenzoyl benzoic acid,benzoic acid, 2-4-chlorobenzoyl,o-p-chlorobenzoyl benzoic acid,2-p-chlorobenzoyl benzoic acid,o-4-chlorobenzoyl benzoic acid,2-4'-chlorobenzoyl benzoic acid,unii-3u7w4yoy3r,3u7w4yoy3r,chembl81936,2-4-chloro-benzoyl-benzoic acid PubChem CID: 66564 IUPAC Name: 2-(4-chlorobenzoyl)benzoic acid SMILES: C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O
| PubChem CID | 66564 |
|---|---|
| CAS | 85-56-3 |
| Molecular Weight (g/mol) | 260.673 |
| MDL Number | MFCD00002474 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Cl)C(=O)O |
| Synonym | 2-4-chlorobenzoyl benzoic acid,benzoic acid, 2-4-chlorobenzoyl,o-p-chlorobenzoyl benzoic acid,2-p-chlorobenzoyl benzoic acid,o-4-chlorobenzoyl benzoic acid,2-4'-chlorobenzoyl benzoic acid,unii-3u7w4yoy3r,3u7w4yoy3r,chembl81936,2-4-chloro-benzoyl-benzoic acid |
| IUPAC Name | 2-(4-chlorobenzoyl)benzoic acid |
| InChI Key | YWECCEXWKFHHQJ-UHFFFAOYSA-N |
| Molecular Formula | C14H9ClO3 |
4-Iodo-2-(trifluoromethyl)benzonitrile 98.0+%, TCI America™
CAS: 101066-87-9 Molecular Formula: C8H3F3IN Molecular Weight (g/mol): 297.019 MDL Number: MFCD08458091 InChI Key: RBRTXKYFMXVIER-UHFFFAOYSA-N Synonym: 4-iodo-2-trifluoromethyl benzonitrile,2-cyano-5-iodobenzotrifluoride,benzonitrile, 4-iodo-2-trifluoromethyl,2-trifluoromethyl-4-iodobenzonitrile,4-cyano-3-trifluoromethyl-1-iodobenzene,4-cyano-3-trifluoromethyl iodobenzene,4-iodo-2-trifluoromethyl benzenecarbonitrile,pubchem4810,acmc-1bqw7,ksc494m4b PubChem CID: 16218337 IUPAC Name: 4-iodo-2-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1I)C(F)(F)F)C#N
| PubChem CID | 16218337 |
|---|---|
| CAS | 101066-87-9 |
| Molecular Weight (g/mol) | 297.019 |
| MDL Number | MFCD08458091 |
| SMILES | C1=CC(=C(C=C1I)C(F)(F)F)C#N |
| Synonym | 4-iodo-2-trifluoromethyl benzonitrile,2-cyano-5-iodobenzotrifluoride,benzonitrile, 4-iodo-2-trifluoromethyl,2-trifluoromethyl-4-iodobenzonitrile,4-cyano-3-trifluoromethyl-1-iodobenzene,4-cyano-3-trifluoromethyl iodobenzene,4-iodo-2-trifluoromethyl benzenecarbonitrile,pubchem4810,acmc-1bqw7,ksc494m4b |
| IUPAC Name | 4-iodo-2-(trifluoromethyl)benzonitrile |
| InChI Key | RBRTXKYFMXVIER-UHFFFAOYSA-N |
| Molecular Formula | C8H3F3IN |
4,4'-Difluorodiphenylmethane 99.0+%, TCI America™
CAS: 457-68-1 Molecular Formula: C13H10F2 Molecular Weight (g/mol): 204.22 MDL Number: MFCD00000360 InChI Key: DXQVFHQUHOFROC-UHFFFAOYSA-N Synonym: bis 4-fluorophenyl methane,4,4'-difluorodiphenylmethane,1,1'-methylenebis 4-fluorobenzene,1-fluoro-4-4-fluorophenyl methyl benzene,benzene, 1,1'-methylenebis 4-fluoro,4-fluoro-1-4-fluorophenyl methyl benzene,4,4'-difluorodiphenylamine,bis-4-fluorophenyl methane,4,4'-difluorodiphenyl methane,1,1-methylenebis 4-fluorobenzene PubChem CID: 96094 IUPAC Name: 1-fluoro-4-[(4-fluorophenyl)methyl]benzene SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)F)F
| PubChem CID | 96094 |
|---|---|
| CAS | 457-68-1 |
| Molecular Weight (g/mol) | 204.22 |
| MDL Number | MFCD00000360 |
| SMILES | C1=CC(=CC=C1CC2=CC=C(C=C2)F)F |
| Synonym | bis 4-fluorophenyl methane,4,4'-difluorodiphenylmethane,1,1'-methylenebis 4-fluorobenzene,1-fluoro-4-4-fluorophenyl methyl benzene,benzene, 1,1'-methylenebis 4-fluoro,4-fluoro-1-4-fluorophenyl methyl benzene,4,4'-difluorodiphenylamine,bis-4-fluorophenyl methane,4,4'-difluorodiphenyl methane,1,1-methylenebis 4-fluorobenzene |
| IUPAC Name | 1-fluoro-4-[(4-fluorophenyl)methyl]benzene |
| InChI Key | DXQVFHQUHOFROC-UHFFFAOYSA-N |
| Molecular Formula | C13H10F2 |
4-Chloro-3-nitrobenzyl Alcohol 98.0+%, TCI America™
CAS: 55912-20-4 Molecular Formula: C7H6ClNO3 Molecular Weight (g/mol): 187.579 MDL Number: MFCD00007086 InChI Key: QLLRQJDSYJIXTN-UHFFFAOYSA-N PubChem CID: 91933 IUPAC Name: (4-chloro-3-nitrophenyl)methanol SMILES: C1=CC(=C(C=C1CO)[N+](=O)[O-])Cl
| PubChem CID | 91933 |
|---|---|
| CAS | 55912-20-4 |
| Molecular Weight (g/mol) | 187.579 |
| MDL Number | MFCD00007086 |
| SMILES | C1=CC(=C(C=C1CO)[N+](=O)[O-])Cl |
| IUPAC Name | (4-chloro-3-nitrophenyl)methanol |
| InChI Key | QLLRQJDSYJIXTN-UHFFFAOYSA-N |
| Molecular Formula | C7H6ClNO3 |
Teriflunomide 98.0+%, TCI America™
CAS: 163451-81-8 Molecular Formula: C12H9F3N2O2 Molecular Weight (g/mol): 270.211 MDL Number: MFCD00910058 InChI Key: UTNUDOFZCWSZMS-YFHOEESVSA-N Synonym: N-[4-(Trifluoromethyl)phenyl]-2-cyano-3-hydroxycrotonamide, (Z)-2-Cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]-2-butenamide PubChem CID: 54684141 ChEBI: CHEBI:68540 IUPAC Name: (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-enamide SMILES: CC(=C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)O
| PubChem CID | 54684141 |
|---|---|
| CAS | 163451-81-8 |
| Molecular Weight (g/mol) | 270.211 |
| ChEBI | CHEBI:68540 |
| MDL Number | MFCD00910058 |
| SMILES | CC(=C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)O |
| Synonym | N-[4-(Trifluoromethyl)phenyl]-2-cyano-3-hydroxycrotonamide, (Z)-2-Cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]-2-butenamide |
| IUPAC Name | (Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)phenyl]but-2-enamide |
| InChI Key | UTNUDOFZCWSZMS-YFHOEESVSA-N |
| Molecular Formula | C12H9F3N2O2 |
4-Methoxysalicylic Acid 98.0+%, TCI America™
CAS: 2237-36-7 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00002450 InChI Key: MRIXVKKOHPQOFK-UHFFFAOYSA-N Synonym: 4-methoxysalicylic acid,2-hydroxy-p-anisic acid,2-hydroxy-4-methoxy-benzoic acid,benzoic acid, 2-hydroxy-4-methoxy,2-hydroxy-4-methoxybenzoes,4-methoxysalicylicacid,pubchem18895,4-methoxy salicylic acid,4-methoxy-salicylic acid,acmc-1cs6b PubChem CID: 75231 IUPAC Name: 2-hydroxy-4-methoxybenzoic acid SMILES: COC1=CC=C(C(O)=O)C(O)=C1
| PubChem CID | 75231 |
|---|---|
| CAS | 2237-36-7 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00002450 |
| SMILES | COC1=CC=C(C(O)=O)C(O)=C1 |
| Synonym | 4-methoxysalicylic acid,2-hydroxy-p-anisic acid,2-hydroxy-4-methoxy-benzoic acid,benzoic acid, 2-hydroxy-4-methoxy,2-hydroxy-4-methoxybenzoes,4-methoxysalicylicacid,pubchem18895,4-methoxy salicylic acid,4-methoxy-salicylic acid,acmc-1cs6b |
| IUPAC Name | 2-hydroxy-4-methoxybenzoic acid |
| InChI Key | MRIXVKKOHPQOFK-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
2,5-Dimethoxytoluene 98.0+%, TCI America™
CAS: 24599-58-4 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00041901 InChI Key: IQISOVKPFBLQIQ-UHFFFAOYSA-N Synonym: 2,5-dimethoxytoluene,benzene, 1,4-dimethoxy-2-methyl,toluene, 2,5-dimethoxy,methyl hydroquinone dimethyl ester,2-methylhydroquinone dimethyl ether,1,4-dimethoxy-2-methyl-benzene,pubchem4543,2,5-dimethoxy toluene,acmc-209gdc PubChem CID: 90552 IUPAC Name: 1,4-dimethoxy-2-methylbenzene SMILES: CC1=C(C=CC(=C1)OC)OC
| PubChem CID | 90552 |
|---|---|
| CAS | 24599-58-4 |
| Molecular Weight (g/mol) | 152.193 |
| MDL Number | MFCD00041901 |
| SMILES | CC1=C(C=CC(=C1)OC)OC |
| Synonym | 2,5-dimethoxytoluene,benzene, 1,4-dimethoxy-2-methyl,toluene, 2,5-dimethoxy,methyl hydroquinone dimethyl ester,2-methylhydroquinone dimethyl ether,1,4-dimethoxy-2-methyl-benzene,pubchem4543,2,5-dimethoxy toluene,acmc-209gdc |
| IUPAC Name | 1,4-dimethoxy-2-methylbenzene |
| InChI Key | IQISOVKPFBLQIQ-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
Phenylsulfonylacetonitrile 98.0+%, TCI America™
CAS: 7605-28-9 Molecular Formula: C8H7NO2S Molecular Weight (g/mol): 181.209 MDL Number: MFCD00007550 InChI Key: ZFCFFNGBCVAUDE-UHFFFAOYSA-N Synonym: benzenesulfonylacetonitrile,phenylsulfonyl acetonitrile,2-phenylsulfonyl acetonitrile,phenylsulfonylacetonitrile,2-benzenesulfonyl acetonitrile,phenylsulphonylacetonitrile,acetonitrile, phenylsulfonyl,benzenesulphonyl acetonitrile,benzenesulfonyl-acetonitrile,2-phenylsulfonyl ethanenitrile PubChem CID: 82077 IUPAC Name: 2-(benzenesulfonyl)acetonitrile SMILES: C1=CC=C(C=C1)S(=O)(=O)CC#N
| PubChem CID | 82077 |
|---|---|
| CAS | 7605-28-9 |
| Molecular Weight (g/mol) | 181.209 |
| MDL Number | MFCD00007550 |
| SMILES | C1=CC=C(C=C1)S(=O)(=O)CC#N |
| Synonym | benzenesulfonylacetonitrile,phenylsulfonyl acetonitrile,2-phenylsulfonyl acetonitrile,phenylsulfonylacetonitrile,2-benzenesulfonyl acetonitrile,phenylsulphonylacetonitrile,acetonitrile, phenylsulfonyl,benzenesulphonyl acetonitrile,benzenesulfonyl-acetonitrile,2-phenylsulfonyl ethanenitrile |
| IUPAC Name | 2-(benzenesulfonyl)acetonitrile |
| InChI Key | ZFCFFNGBCVAUDE-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO2S |
1-Benzyl-3-pyrrolidinol 96.0+%, TCI America™
CAS: 775-15-5 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD00012132 InChI Key: YQMXOIAIYXXXEE-UHFFFAOYSA-N PubChem CID: 69889 IUPAC Name: 1-benzylpyrrolidin-3-ol SMILES: C1CN(CC1O)CC2=CC=CC=C2
| PubChem CID | 69889 |
|---|---|
| CAS | 775-15-5 |
| Molecular Weight (g/mol) | 177.247 |
| MDL Number | MFCD00012132 |
| SMILES | C1CN(CC1O)CC2=CC=CC=C2 |
| IUPAC Name | 1-benzylpyrrolidin-3-ol |
| InChI Key | YQMXOIAIYXXXEE-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO |
1-Benzyl-3-p-tolyltriazene 98.0+%, TCI America™
CAS: 17683-09-9 Molecular Formula: C14H15N3 Molecular Weight (g/mol): 225.30 MDL Number: MFCD00038226 InChI Key: IWCGEJKKDAJKJE-UHFFFAOYSA-N Synonym: 3-p-Tolyl-1-benzyltriazene PubChem CID: 87234 IUPAC Name: 1-benzyl-3-(4-methylphenyl)triaz-1-ene SMILES: CC1=CC=C(NN=NCC2=CC=CC=C2)C=C1
| PubChem CID | 87234 |
|---|---|
| CAS | 17683-09-9 |
| Molecular Weight (g/mol) | 225.30 |
| MDL Number | MFCD00038226 |
| SMILES | CC1=CC=C(NN=NCC2=CC=CC=C2)C=C1 |
| Synonym | 3-p-Tolyl-1-benzyltriazene |
| IUPAC Name | 1-benzyl-3-(4-methylphenyl)triaz-1-ene |
| InChI Key | IWCGEJKKDAJKJE-UHFFFAOYSA-N |
| Molecular Formula | C14H15N3 |
2-Iodotoluene (stabilized with Copper chip) 98.0+%, TCI America™
CAS: 615-37-2 Molecular Formula: C7H7I Molecular Weight (g/mol): 218.037 MDL Number: MFCD00001042 InChI Key: RINOYHWVBUKAQE-UHFFFAOYSA-N Synonym: 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 PubChem CID: 5128 ChEBI: CHEBI:39813 IUPAC Name: 1-iodo-2-methylbenzene SMILES: CC1=CC=CC=C1I
| PubChem CID | 5128 |
|---|---|
| CAS | 615-37-2 |
| Molecular Weight (g/mol) | 218.037 |
| ChEBI | CHEBI:39813 |
| MDL Number | MFCD00001042 |
| SMILES | CC1=CC=CC=C1I |
| Synonym | 2-iodotoluene,o-iodotoluene,o-tolyl iodide,benzene, 1-iodo-2-methyl,o-methyliodobenzene,toluene, o-iodo,iodotoluene,ortho-iodotoluene,2-methyliodobenzene,unii-8ok4h85t07 |
| IUPAC Name | 1-iodo-2-methylbenzene |
| InChI Key | RINOYHWVBUKAQE-UHFFFAOYSA-N |
| Molecular Formula | C7H7I |
1-Bromo-4-nonylbenzene 95.0+%, TCI America™
CAS: 51554-94-0 Molecular Formula: C15H23Br Molecular Weight (g/mol): 283.25 MDL Number: MFCD00061116 InChI Key: LVCWOFRWEVUMNY-UHFFFAOYSA-N Synonym: 1-bromo-4-n-nonylbenzene,bromononylbenzene,4-nonylbromobenzene,4-n-nonylbromobenzene,4-nonylphenyl bromide,acmc-209kuh,4-bromo-1-nonylbenzene,1-bromo-4-nonylbenzene PubChem CID: 12603095 IUPAC Name: 1-bromo-4-nonylbenzene SMILES: CCCCCCCCCC1=CC=C(Br)C=C1
| PubChem CID | 12603095 |
|---|---|
| CAS | 51554-94-0 |
| Molecular Weight (g/mol) | 283.25 |
| MDL Number | MFCD00061116 |
| SMILES | CCCCCCCCCC1=CC=C(Br)C=C1 |
| Synonym | 1-bromo-4-n-nonylbenzene,bromononylbenzene,4-nonylbromobenzene,4-n-nonylbromobenzene,4-nonylphenyl bromide,acmc-209kuh,4-bromo-1-nonylbenzene,1-bromo-4-nonylbenzene |
| IUPAC Name | 1-bromo-4-nonylbenzene |
| InChI Key | LVCWOFRWEVUMNY-UHFFFAOYSA-N |
| Molecular Formula | C15H23Br |
3-(4-Chlorophenyl)-1,1-dimethylurea 95.0+%, TCI America™
CAS: 150-68-5 Molecular Formula: C9H11ClN2O Molecular Weight (g/mol): 198.65 MDL Number: MFCD00018556 InChI Key: BMLIZLVNXIYGCK-UHFFFAOYSA-N Synonym: monuron,3-4-chlorophenyl-1,1-dimethylurea,chlorfenidim,lirobetarex,monurex,monurox,monuruon,monuuron,telvar,herbicides, monuron PubChem CID: 8800 ChEBI: CHEBI:38214 IUPAC Name: 1-(4-chlorophenyl)-3,3-dimethylurea SMILES: CN(C)C(=O)NC1=CC=C(Cl)C=C1
| PubChem CID | 8800 |
|---|---|
| CAS | 150-68-5 |
| Molecular Weight (g/mol) | 198.65 |
| ChEBI | CHEBI:38214 |
| MDL Number | MFCD00018556 |
| SMILES | CN(C)C(=O)NC1=CC=C(Cl)C=C1 |
| Synonym | monuron,3-4-chlorophenyl-1,1-dimethylurea,chlorfenidim,lirobetarex,monurex,monurox,monuruon,monuuron,telvar,herbicides, monuron |
| IUPAC Name | 1-(4-chlorophenyl)-3,3-dimethylurea |
| InChI Key | BMLIZLVNXIYGCK-UHFFFAOYSA-N |
| Molecular Formula | C9H11ClN2O |
1-Methyl-3-p-tolyltriazene 98.0+%, TCI America™
CAS: 21124-13-0 Molecular Formula: C8H11N3 Molecular Weight (g/mol): 149.197 MDL Number: MFCD00008282 InChI Key: DNGJVDGPCGXBFF-UHFFFAOYSA-N PubChem CID: 30492 IUPAC Name: 4-methyl-N-(methyldiazenyl)aniline SMILES: CC1=CC=C(C=C1)NN=NC
| PubChem CID | 30492 |
|---|---|
| CAS | 21124-13-0 |
| Molecular Weight (g/mol) | 149.197 |
| MDL Number | MFCD00008282 |
| SMILES | CC1=CC=C(C=C1)NN=NC |
| IUPAC Name | 4-methyl-N-(methyldiazenyl)aniline |
| InChI Key | DNGJVDGPCGXBFF-UHFFFAOYSA-N |
| Molecular Formula | C8H11N3 |