Benzene and substituted derivatives
Filtered Search Results
Ethyl p-Anisate 99.0+%, TCI America™
CAS: 94-30-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00015151 InChI Key: FHUODBDRWMIBQP-UHFFFAOYSA-N Synonym: ethyl p-anisate,ethyl anisate,ethyl p-methoxybenzoate,p-anisic acid, ethyl ester,benzoic acid, 4-methoxy-, ethyl ester,4-methoxybenzoic acid ethyl ester,benzoic acid, p-methoxy-, ethyl ester,ethyl p-anisoate,unii-kj95h2s7nm,p-anisic acid ethyl ester PubChem CID: 60979 IUPAC Name: ethyl 4-methoxybenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)OC
| PubChem CID | 60979 |
|---|---|
| CAS | 94-30-4 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00015151 |
| SMILES | CCOC(=O)C1=CC=C(C=C1)OC |
| Synonym | ethyl p-anisate,ethyl anisate,ethyl p-methoxybenzoate,p-anisic acid, ethyl ester,benzoic acid, 4-methoxy-, ethyl ester,4-methoxybenzoic acid ethyl ester,benzoic acid, p-methoxy-, ethyl ester,ethyl p-anisoate,unii-kj95h2s7nm,p-anisic acid ethyl ester |
| IUPAC Name | ethyl 4-methoxybenzoate |
| InChI Key | FHUODBDRWMIBQP-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
2-Ethoxybenzonitrile 98.0+%, TCI America™
CAS: 6609-57-0 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00001789 InChI Key: DXTLCLWOCYLDHL-UHFFFAOYSA-N Synonym: o-ethoxybenzonitrile,benzonitrile, ethoxy,2-ethoxybenzenecarbonitrile,o-ethoxybenzontrle,acmc-20anwu,2-ethoxy benzonitrile,2-ethoxy-benzonitrile,pubchem4773,benzonitrile, 2-ethoxy,2-ethoxybenzonitrile PubChem CID: 576922 IUPAC Name: 2-ethoxybenzonitrile SMILES: CCOC1=CC=CC=C1C#N
| PubChem CID | 576922 |
|---|---|
| CAS | 6609-57-0 |
| Molecular Weight (g/mol) | 147.177 |
| MDL Number | MFCD00001789 |
| SMILES | CCOC1=CC=CC=C1C#N |
| Synonym | o-ethoxybenzonitrile,benzonitrile, ethoxy,2-ethoxybenzenecarbonitrile,o-ethoxybenzontrle,acmc-20anwu,2-ethoxy benzonitrile,2-ethoxy-benzonitrile,pubchem4773,benzonitrile, 2-ethoxy,2-ethoxybenzonitrile |
| IUPAC Name | 2-ethoxybenzonitrile |
| InChI Key | DXTLCLWOCYLDHL-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO |
5-Bromo-2-methoxyaniline 97.0+%, TCI America™
CAS: 6358-77-6 Molecular Formula: C7H8BrNO Molecular Weight (g/mol): 202.05 MDL Number: MFCD04037882 InChI Key: OPGNSNDTPPIYPG-UHFFFAOYSA-N Synonym: 5-bromo-2-methoxy aniline,2-amino-4-bromoanisole,5-bromo-o-anisidine,benzenamine, 5-bromo-2-methoxy,5-bromo-2-methoxy-aniline,4-bromo-2-aminoanisole,2-methoxy-5-bromoaniline,acmc-1b9k2,5-bromo-2-methoxyphenylamine,5-bromo-2-methyloxy aniline PubChem CID: 3585328 IUPAC Name: 5-bromo-2-methoxyaniline SMILES: COC1=C(N)C=C(Br)C=C1
| PubChem CID | 3585328 |
|---|---|
| CAS | 6358-77-6 |
| Molecular Weight (g/mol) | 202.05 |
| MDL Number | MFCD04037882 |
| SMILES | COC1=C(N)C=C(Br)C=C1 |
| Synonym | 5-bromo-2-methoxy aniline,2-amino-4-bromoanisole,5-bromo-o-anisidine,benzenamine, 5-bromo-2-methoxy,5-bromo-2-methoxy-aniline,4-bromo-2-aminoanisole,2-methoxy-5-bromoaniline,acmc-1b9k2,5-bromo-2-methoxyphenylamine,5-bromo-2-methyloxy aniline |
| IUPAC Name | 5-bromo-2-methoxyaniline |
| InChI Key | OPGNSNDTPPIYPG-UHFFFAOYSA-N |
| Molecular Formula | C7H8BrNO |
alpha-Bromo-p-xylene 98.0+%, TCI America™
CAS: 104-81-4 Molecular Formula: C8H9Br Molecular Weight (g/mol): 185.064 MDL Number: MFCD00000181 InChI Key: WZRKSPFYXUXINF-UHFFFAOYSA-N Synonym: 4-methylbenzyl bromide,1-bromomethyl-4-methylbenzene,p-xylyl bromide,p-methylbenzyl bromide,alpha-bromo-p-xylene,benzene, 1-bromomethyl-4-methyl,4-bromomethyl toluene,p-bromomethyl toluene,alpha-bromo-p-xylol,1-bromomethyl-4-methyl-benzene PubChem CID: 7721 IUPAC Name: 1-(bromomethyl)-4-methylbenzene SMILES: CC1=CC=C(C=C1)CBr
| PubChem CID | 7721 |
|---|---|
| CAS | 104-81-4 |
| Molecular Weight (g/mol) | 185.064 |
| MDL Number | MFCD00000181 |
| SMILES | CC1=CC=C(C=C1)CBr |
| Synonym | 4-methylbenzyl bromide,1-bromomethyl-4-methylbenzene,p-xylyl bromide,p-methylbenzyl bromide,alpha-bromo-p-xylene,benzene, 1-bromomethyl-4-methyl,4-bromomethyl toluene,p-bromomethyl toluene,alpha-bromo-p-xylol,1-bromomethyl-4-methyl-benzene |
| IUPAC Name | 1-(bromomethyl)-4-methylbenzene |
| InChI Key | WZRKSPFYXUXINF-UHFFFAOYSA-N |
| Molecular Formula | C8H9Br |
1,3-Benzenedisulfonamide 98.0+%, TCI America™
CAS: 3701-01-7 Molecular Formula: C6H8N2O4S2 Molecular Weight (g/mol): 236.26 MDL Number: MFCD00025383 InChI Key: HUYYFHGIHVULSU-UHFFFAOYSA-N PubChem CID: 3090044 ChEBI: CHEBI:35085 IUPAC Name: benzene-1,3-disulfonamide SMILES: C1=CC(=CC(=C1)S(=O)(=O)N)S(=O)(=O)N
| PubChem CID | 3090044 |
|---|---|
| CAS | 3701-01-7 |
| Molecular Weight (g/mol) | 236.26 |
| ChEBI | CHEBI:35085 |
| MDL Number | MFCD00025383 |
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)N)S(=O)(=O)N |
| IUPAC Name | benzene-1,3-disulfonamide |
| InChI Key | HUYYFHGIHVULSU-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O4S2 |
4-Methoxybenzyl Acetate 98.0+%, TCI America™
CAS: 104-21-2 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00038509 InChI Key: HFNGYHHRRMSKEU-UHFFFAOYSA-N Synonym: 4-methoxybenzyl acetate,anisyl acetate,cassie ketone,4-methoxyphenyl methyl acetate,p-anisyl acetate,p-methoxybenzyl acetate,p-methoxybenzyl alcohol acetate,benzyl alcohol, p-methoxy-, acetate,benzenemethanol, 4-methoxy-, acetate,benzenemethanol, 4-methoxy-, 1-acetate PubChem CID: 7695 ChEBI: CHEBI:86743 IUPAC Name: (4-methoxyphenyl)methyl acetate SMILES: COC1=CC=C(COC(C)=O)C=C1
| PubChem CID | 7695 |
|---|---|
| CAS | 104-21-2 |
| Molecular Weight (g/mol) | 180.20 |
| ChEBI | CHEBI:86743 |
| MDL Number | MFCD00038509 |
| SMILES | COC1=CC=C(COC(C)=O)C=C1 |
| Synonym | 4-methoxybenzyl acetate,anisyl acetate,cassie ketone,4-methoxyphenyl methyl acetate,p-anisyl acetate,p-methoxybenzyl acetate,p-methoxybenzyl alcohol acetate,benzyl alcohol, p-methoxy-, acetate,benzenemethanol, 4-methoxy-, acetate,benzenemethanol, 4-methoxy-, 1-acetate |
| IUPAC Name | (4-methoxyphenyl)methyl acetate |
| InChI Key | HFNGYHHRRMSKEU-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-(Trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™
CAS: 2991-42-6 Molecular Formula: C7H4ClF3O2S Molecular Weight (g/mol): 244.61 MDL Number: MFCD00042422 InChI Key: OZDCZHDOIBUGAJ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl PubChem CID: 2777399 IUPAC Name: 4-(trifluoromethyl)benzene-1-sulfonyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O
| PubChem CID | 2777399 |
|---|---|
| CAS | 2991-42-6 |
| Molecular Weight (g/mol) | 244.61 |
| MDL Number | MFCD00042422 |
| SMILES | FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O |
| Synonym | 4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl |
| IUPAC Name | 4-(trifluoromethyl)benzene-1-sulfonyl chloride |
| InChI Key | OZDCZHDOIBUGAJ-UHFFFAOYSA-N |
| Molecular Formula | C7H4ClF3O2S |
4-(Trifluoromethylthio)benzyl Bromide 97.0+%, TCI America™
CAS: 21101-63-3 Molecular Formula: C8H6BrF3S Molecular Weight (g/mol): 271.095 MDL Number: MFCD00129189 InChI Key: VAYGJBCOCRVROJ-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio benzyl bromide,4-bromomethyl phenyl trifluoromethyl sulfane,4-trifluoromethylthio benzylbromide,1-bromomethyl-4-trifluoromethyl sulfanyl benzene,benzene, 1-bromomethyl-4-trifluoromethyl thio,1-bromomethyl-4-trifluoromethylsulfanyl-benzene,1-bromomethyl-4-trifluoromethylsulfanyl benzene,acmc-1coe0,4-trifluoromethylthiobenzyl bromide,4 trifluoromethylthio benzyl bromide PubChem CID: 2777882 IUPAC Name: 1-(bromomethyl)-4-(trifluoromethylsulfanyl)benzene SMILES: C1=CC(=CC=C1CBr)SC(F)(F)F
| PubChem CID | 2777882 |
|---|---|
| CAS | 21101-63-3 |
| Molecular Weight (g/mol) | 271.095 |
| MDL Number | MFCD00129189 |
| SMILES | C1=CC(=CC=C1CBr)SC(F)(F)F |
| Synonym | 4-trifluoromethylthio benzyl bromide,4-bromomethyl phenyl trifluoromethyl sulfane,4-trifluoromethylthio benzylbromide,1-bromomethyl-4-trifluoromethyl sulfanyl benzene,benzene, 1-bromomethyl-4-trifluoromethyl thio,1-bromomethyl-4-trifluoromethylsulfanyl-benzene,1-bromomethyl-4-trifluoromethylsulfanyl benzene,acmc-1coe0,4-trifluoromethylthiobenzyl bromide,4 trifluoromethylthio benzyl bromide |
| IUPAC Name | 1-(bromomethyl)-4-(trifluoromethylsulfanyl)benzene |
| InChI Key | VAYGJBCOCRVROJ-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3S |
N-tert-Butylbenzylamine 96.0+%, TCI America™
CAS: 3378-72-1 Molecular Formula: C11H17N Molecular Weight (g/mol): 163.264 MDL Number: MFCD00008798 InChI Key: DLSOILHAKCBARI-UHFFFAOYSA-N Synonym: n-tert-butyl benzylamine,n-tert-butylbenzylamine,n-benzyl-tert-butylamine,tert-butylbenzylamine,n-t-butylbenzylamine,benzenemethanamine, n-1,1-dimethylethyl,benzyl tert-butyl amine,tert-butyl benzylamine,t-butylbenzylamine,n-1,1-dimethylethyl benzylamine PubChem CID: 76908 IUPAC Name: N-benzyl-2-methylpropan-2-amine SMILES: CC(C)(C)NCC1=CC=CC=C1
| PubChem CID | 76908 |
|---|---|
| CAS | 3378-72-1 |
| Molecular Weight (g/mol) | 163.264 |
| MDL Number | MFCD00008798 |
| SMILES | CC(C)(C)NCC1=CC=CC=C1 |
| Synonym | n-tert-butyl benzylamine,n-tert-butylbenzylamine,n-benzyl-tert-butylamine,tert-butylbenzylamine,n-t-butylbenzylamine,benzenemethanamine, n-1,1-dimethylethyl,benzyl tert-butyl amine,tert-butyl benzylamine,t-butylbenzylamine,n-1,1-dimethylethyl benzylamine |
| IUPAC Name | N-benzyl-2-methylpropan-2-amine |
| InChI Key | DLSOILHAKCBARI-UHFFFAOYSA-N |
| Molecular Formula | C11H17N |
4-Benzyloxy-1,3-butanediol 97.0+%, TCI America™
CAS: 71998-70-4 Molecular Formula: C11H16O3 Molecular Weight (g/mol): 196.246 InChI Key: ZVVBUAFZGGHYAO-UHFFFAOYSA-N PubChem CID: 13181679 IUPAC Name: 4-phenylmethoxybutane-1,3-diol SMILES: C1=CC=C(C=C1)COCC(CCO)O
| PubChem CID | 13181679 |
|---|---|
| CAS | 71998-70-4 |
| Molecular Weight (g/mol) | 196.246 |
| SMILES | C1=CC=C(C=C1)COCC(CCO)O |
| IUPAC Name | 4-phenylmethoxybutane-1,3-diol |
| InChI Key | ZVVBUAFZGGHYAO-UHFFFAOYSA-N |
| Molecular Formula | C11H16O3 |
4-Iodophenetole 98.0+%, TCI America™
CAS: 699-08-1 Molecular Formula: C8H9IO Molecular Weight (g/mol): 248.063 MDL Number: MFCD00061124 InChI Key: VSIIHWOJPSSIDI-UHFFFAOYSA-N Synonym: 4-iodophenetole,p-iodophenetole,1-ethoxy-4-iodo-benzene,4-ethoxyiodobenzene,4-ethoxy-4-iodobenzene,benzene, 1-ethoxy-4-iodo,4-iodophenyl ethyl ether,phenetole, p-iodo,p-ethoxyiodobenzene,ethyl 4-iodophenyl ether PubChem CID: 220700 IUPAC Name: 1-ethoxy-4-iodobenzene SMILES: CCOC1=CC=C(C=C1)I
| PubChem CID | 220700 |
|---|---|
| CAS | 699-08-1 |
| Molecular Weight (g/mol) | 248.063 |
| MDL Number | MFCD00061124 |
| SMILES | CCOC1=CC=C(C=C1)I |
| Synonym | 4-iodophenetole,p-iodophenetole,1-ethoxy-4-iodo-benzene,4-ethoxyiodobenzene,4-ethoxy-4-iodobenzene,benzene, 1-ethoxy-4-iodo,4-iodophenyl ethyl ether,phenetole, p-iodo,p-ethoxyiodobenzene,ethyl 4-iodophenyl ether |
| IUPAC Name | 1-ethoxy-4-iodobenzene |
| InChI Key | VSIIHWOJPSSIDI-UHFFFAOYSA-N |
| Molecular Formula | C8H9IO |
2,5-Difluoro-4-nitrotoluene 98.0+%, TCI America™
CAS: 141412-60-4 Molecular Formula: C7H5F2NO2 Molecular Weight (g/mol): 173.12 MDL Number: MFCD06200905 InChI Key: ABWWQMGGJXKGBL-UHFFFAOYSA-N Synonym: 2,5-difluoro-4-nitrotoluene,2,5-difluoro-4-methylnitrobenzene,2,5-difluoro-4-methyl nitrobenzene,benzene, 1,4-difluoro-2-methyl-5-nitro,2,5-difluoro-1-methyl-4-nitrobenzene,1,4-difluoro-2-methyl-5-nitro-benzene,pubchem2555,difluoromethylnitrobenzene,ksc495e0j,acmc-1c025 PubChem CID: 230658 IUPAC Name: 1,4-difluoro-2-methyl-5-nitrobenzene SMILES: CC1=CC(F)=C(C=C1F)[N+]([O-])=O
| PubChem CID | 230658 |
|---|---|
| CAS | 141412-60-4 |
| Molecular Weight (g/mol) | 173.12 |
| MDL Number | MFCD06200905 |
| SMILES | CC1=CC(F)=C(C=C1F)[N+]([O-])=O |
| Synonym | 2,5-difluoro-4-nitrotoluene,2,5-difluoro-4-methylnitrobenzene,2,5-difluoro-4-methyl nitrobenzene,benzene, 1,4-difluoro-2-methyl-5-nitro,2,5-difluoro-1-methyl-4-nitrobenzene,1,4-difluoro-2-methyl-5-nitro-benzene,pubchem2555,difluoromethylnitrobenzene,ksc495e0j,acmc-1c025 |
| IUPAC Name | 1,4-difluoro-2-methyl-5-nitrobenzene |
| InChI Key | ABWWQMGGJXKGBL-UHFFFAOYSA-N |
| Molecular Formula | C7H5F2NO2 |
4-Fluorobenzonitrile 99.0+%, TCI America™
CAS: 1194-02-1 Molecular Formula: C7H4FN Molecular Weight (g/mol): 121.114 MDL Number: MFCD00001812 InChI Key: AEKVBBNGWBBYLL-UHFFFAOYSA-N Synonym: p-fluorobenzonitrile,benzonitrile, 4-fluoro,4-cyanofluorobenzene,p-cyanofluorobenzene,benzonitrile, p-fluoro,4-fluoro-benzonitrile,4-fluorobenzenecarbonitrile,4-fluorobenzonitril,pfbn,1-cyano-4-fluorobenzene PubChem CID: 14517 IUPAC Name: 4-fluorobenzonitrile SMILES: C1=CC(=CC=C1C#N)F
| PubChem CID | 14517 |
|---|---|
| CAS | 1194-02-1 |
| Molecular Weight (g/mol) | 121.114 |
| MDL Number | MFCD00001812 |
| SMILES | C1=CC(=CC=C1C#N)F |
| Synonym | p-fluorobenzonitrile,benzonitrile, 4-fluoro,4-cyanofluorobenzene,p-cyanofluorobenzene,benzonitrile, p-fluoro,4-fluoro-benzonitrile,4-fluorobenzenecarbonitrile,4-fluorobenzonitril,pfbn,1-cyano-4-fluorobenzene |
| IUPAC Name | 4-fluorobenzonitrile |
| InChI Key | AEKVBBNGWBBYLL-UHFFFAOYSA-N |
| Molecular Formula | C7H4FN |
3,5-Dibromobenzyl Bromide 95.0+%, TCI America™
CAS: 56908-88-4 Molecular Formula: C7H5Br3 Molecular Weight (g/mol): 328.83 MDL Number: MFCD00052415 InChI Key: PWTFRUXTAFBWBW-UHFFFAOYSA-N Synonym: 3,5-dibromobenzyl bromide,1,3-dibromo-5-bromomethyl benzene,benzene, 1,3-dibromo-5-bromomethyl,alpha,3,5-tribromotoluene,acmc-20andg,3,5-dibromobenzylbromide,3,5-dibromo benzyl bromide,1,3-bis bromanyl-5-bromomethyl benzene PubChem CID: 143427 IUPAC Name: 1,3-dibromo-5-(bromomethyl)benzene SMILES: BrCC1=CC(Br)=CC(Br)=C1
| PubChem CID | 143427 |
|---|---|
| CAS | 56908-88-4 |
| Molecular Weight (g/mol) | 328.83 |
| MDL Number | MFCD00052415 |
| SMILES | BrCC1=CC(Br)=CC(Br)=C1 |
| Synonym | 3,5-dibromobenzyl bromide,1,3-dibromo-5-bromomethyl benzene,benzene, 1,3-dibromo-5-bromomethyl,alpha,3,5-tribromotoluene,acmc-20andg,3,5-dibromobenzylbromide,3,5-dibromo benzyl bromide,1,3-bis bromanyl-5-bromomethyl benzene |
| IUPAC Name | 1,3-dibromo-5-(bromomethyl)benzene |
| InChI Key | PWTFRUXTAFBWBW-UHFFFAOYSA-N |
| Molecular Formula | C7H5Br3 |
Methyl 3-Hydroxybenzoate 98.0+%, TCI America™
CAS: 19438-10-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002295 InChI Key: YKUCHDXIBAQWSF-UHFFFAOYSA-N Synonym: methyl m-hydroxybenzoate,3-hydroxybenzoic acid methyl ester,m-carbomethoxyphenol,methyl m-oxybenzoate,m-hydroxybenzoic acid methyl ester,benzoic acid, 3-hydroxy-, methyl ester,3-hydroxy-benzoic acid methyl ester,unii-569m9g3stj,3-methoxycarbonyl phenol,benzoic acid, m-hydroxy-, methyl ester PubChem CID: 88068 IUPAC Name: methyl 3-hydroxybenzoate SMILES: COC(=O)C1=CC=CC(O)=C1
| PubChem CID | 88068 |
|---|---|
| CAS | 19438-10-9 |
| Molecular Weight (g/mol) | 152.15 |
| MDL Number | MFCD00002295 |
| SMILES | COC(=O)C1=CC=CC(O)=C1 |
| Synonym | methyl m-hydroxybenzoate,3-hydroxybenzoic acid methyl ester,m-carbomethoxyphenol,methyl m-oxybenzoate,m-hydroxybenzoic acid methyl ester,benzoic acid, 3-hydroxy-, methyl ester,3-hydroxy-benzoic acid methyl ester,unii-569m9g3stj,3-methoxycarbonyl phenol,benzoic acid, m-hydroxy-, methyl ester |
| IUPAC Name | methyl 3-hydroxybenzoate |
| InChI Key | YKUCHDXIBAQWSF-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |