Benzene and substituted derivatives
Filtered Search Results
4-(Aminomethyl)benzoic acid, 99%
CAS: 56-91-7 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00010203 InChI Key: QCTBMLYLENLHLA-UHFFFAOYSA-N Synonym: 4-aminomethyl benzoic acid,4-carboxybenzylamine,pamba,styptopur,gumbix,p-aminomethylbenzoic acid,aminomethylbenzoic acid,benzoic acid, 4-aminomethyl,benzylamine-4-carboxylic acid,alpha-amino-p-toluic acid PubChem CID: 65526 IUPAC Name: 4-(aminomethyl)benzoic acid SMILES: C1=CC(=CC=C1CN)C(=O)O
| PubChem CID | 65526 |
|---|---|
| CAS | 56-91-7 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00010203 |
| SMILES | C1=CC(=CC=C1CN)C(=O)O |
| Synonym | 4-aminomethyl benzoic acid,4-carboxybenzylamine,pamba,styptopur,gumbix,p-aminomethylbenzoic acid,aminomethylbenzoic acid,benzoic acid, 4-aminomethyl,benzylamine-4-carboxylic acid,alpha-amino-p-toluic acid |
| IUPAC Name | 4-(aminomethyl)benzoic acid |
| InChI Key | QCTBMLYLENLHLA-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
GBR 12909 dihydrochloride, Thermo Scientific Chemicals
CAS: 67469-78-7 Molecular Formula: C28H34Cl2F2N2O Molecular Weight (g/mol): 523.49 MDL Number: MFCD00055193 InChI Key: MIBSKSYCRFWIRU-UHFFFAOYSA-N PubChem CID: 104920 ChEBI: CHEBI:64086 IUPAC Name: 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride SMILES: C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl
| PubChem CID | 104920 |
|---|---|
| CAS | 67469-78-7 |
| Molecular Weight (g/mol) | 523.49 |
| ChEBI | CHEBI:64086 |
| MDL Number | MFCD00055193 |
| SMILES | C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl |
| IUPAC Name | 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-(3-phenylpropyl)piperazine;dihydrochloride |
| InChI Key | MIBSKSYCRFWIRU-UHFFFAOYSA-N |
| Molecular Formula | C28H34Cl2F2N2O |
Benzhydryl bromide, 90+%
CAS: 776-74-9 Molecular Formula: C13H11Br Molecular Weight (g/mol): 247.135 MDL Number: MFCD00000134 InChI Key: OQROAIRCEOBYJA-UHFFFAOYSA-N Synonym: bromodiphenylmethane,benzhydryl bromide,diphenylmethyl bromide,diphenylbromomethane,alpha-bromodiphenylmethane,bromo phenyl methyl benzene,benzene, 1,1'-bromomethylene bis,methane, bromodiphenyl,bromomethylene dibenzene,bromodiphenyl methane PubChem CID: 236603 IUPAC Name: [bromo(phenyl)methyl]benzene SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)Br
| PubChem CID | 236603 |
|---|---|
| CAS | 776-74-9 |
| Molecular Weight (g/mol) | 247.135 |
| MDL Number | MFCD00000134 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)Br |
| Synonym | bromodiphenylmethane,benzhydryl bromide,diphenylmethyl bromide,diphenylbromomethane,alpha-bromodiphenylmethane,bromo phenyl methyl benzene,benzene, 1,1'-bromomethylene bis,methane, bromodiphenyl,bromomethylene dibenzene,bromodiphenyl methane |
| IUPAC Name | [bromo(phenyl)methyl]benzene |
| InChI Key | OQROAIRCEOBYJA-UHFFFAOYSA-N |
| Molecular Formula | C13H11Br |
4-Bromostyrene, 96%, stabilized
CAS: 2039-82-9 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.05 MDL Number: MFCD00000110 InChI Key: WGGLDBIZIQMEGH-UHFFFAOYSA-N Synonym: 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu PubChem CID: 16263 IUPAC Name: 1-bromo-4-ethenylbenzene SMILES: BrC1=CC=C(C=C)C=C1
| PubChem CID | 16263 |
|---|---|
| CAS | 2039-82-9 |
| Molecular Weight (g/mol) | 183.05 |
| MDL Number | MFCD00000110 |
| SMILES | BrC1=CC=C(C=C)C=C1 |
| Synonym | 4-bromostyrene,1-bromo-4-vinylbenzene,p-bromostyrene,benzene, 1-bromo-4-ethenyl,styrene, p-bromo,1-4-bromophenyl ethylene,unii-tvk4s80xlu,p-bromo styrene,1-bromo-4-vinyl-benzene,tvk4s80xlu |
| IUPAC Name | 1-bromo-4-ethenylbenzene |
| InChI Key | WGGLDBIZIQMEGH-UHFFFAOYSA-N |
| Molecular Formula | C8H7Br |
4-Bromo-2-fluorobenzyl bromide, 98%
CAS: 76283-09-5 Molecular Formula: C7H5Br2F Molecular Weight (g/mol): 267.923 MDL Number: MFCD00055467 InChI Key: XMHNLZXYPAULDF-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorobenzyl bromide,4-bromo-1-bromomethyl-2-fluorobenzene,2-fluoro-4-bromobenzyl bromide,4-bromo-2-fluorobenzylbromide,2-fluoro-4-bromo-benzylbromide,alpha,4-dibromo-2-fluorotoluene,unii-0z26xyc1jy,4,alpha-dibromo-2-fluorotoluene,4-bromo-1-bromomethyl-2-fluoro-benzene,0z26xyc1jy PubChem CID: 2733660 IUPAC Name: 4-bromo-1-(bromomethyl)-2-fluorobenzene SMILES: C1=CC(=C(C=C1Br)F)CBr
| PubChem CID | 2733660 |
|---|---|
| CAS | 76283-09-5 |
| Molecular Weight (g/mol) | 267.923 |
| MDL Number | MFCD00055467 |
| SMILES | C1=CC(=C(C=C1Br)F)CBr |
| Synonym | 4-bromo-2-fluorobenzyl bromide,4-bromo-1-bromomethyl-2-fluorobenzene,2-fluoro-4-bromobenzyl bromide,4-bromo-2-fluorobenzylbromide,2-fluoro-4-bromo-benzylbromide,alpha,4-dibromo-2-fluorotoluene,unii-0z26xyc1jy,4,alpha-dibromo-2-fluorotoluene,4-bromo-1-bromomethyl-2-fluoro-benzene,0z26xyc1jy |
| IUPAC Name | 4-bromo-1-(bromomethyl)-2-fluorobenzene |
| InChI Key | XMHNLZXYPAULDF-UHFFFAOYSA-N |
| Molecular Formula | C7H5Br2F |
Fluconazole 98.0+%, TCI America™
CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.277 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
| PubChem CID | 3365 |
|---|---|
| CAS | 86386-73-4 |
| Molecular Weight (g/mol) | 306.277 |
| ChEBI | CHEBI:46081 |
| SMILES | C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O |
| Synonym | fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol |
| IUPAC Name | 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol |
| InChI Key | RFHAOTPXVQNOHP-UHFFFAOYSA-N |
| Molecular Formula | C13H12F2N6O |
Sodium tetrakis[3,5-bis(trifluoromethyl)phenyl]borate, 97%, may cont. 1-5% water
CAS: 79060-88-1 Molecular Formula: C32H12BF24Na Molecular Weight (g/mol): 886.209 MDL Number: MFCD00043323 InChI Key: LTGMONZOZHXAHO-UHFFFAOYSA-N Synonym: sodium tetrakis 3,5-bis trifluoromethyl phenyl borate,nabarf,sodium tetrakis 3,5-bis trifluoromethyl phenyl boranuide,sodium2-sulfonatoethylmethacrylate,sodium tetrakis 3,5-bis trifluoromethyl phenyl bor,sodium tetrakis 3,5-bis-trifluoromethylphenyl borate,sodiotetrakis 3,5-bis trifluoromethyl phenyl boron v,sodium tetrakis 3,5-bis trifluoromethyl phenyl-borate,sodium tetrakis 3,5-bis trifluoromethyl phenyl borate 1- PubChem CID: 23681909 IUPAC Name: sodium;tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide SMILES: [B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.[Na+]
| PubChem CID | 23681909 |
|---|---|
| CAS | 79060-88-1 |
| Molecular Weight (g/mol) | 886.209 |
| MDL Number | MFCD00043323 |
| SMILES | [B-](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)(C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F.[Na+] |
| Synonym | sodium tetrakis 3,5-bis trifluoromethyl phenyl borate,nabarf,sodium tetrakis 3,5-bis trifluoromethyl phenyl boranuide,sodium2-sulfonatoethylmethacrylate,sodium tetrakis 3,5-bis trifluoromethyl phenyl bor,sodium tetrakis 3,5-bis-trifluoromethylphenyl borate,sodiotetrakis 3,5-bis trifluoromethyl phenyl boron v,sodium tetrakis 3,5-bis trifluoromethyl phenyl-borate,sodium tetrakis 3,5-bis trifluoromethyl phenyl borate 1- |
| IUPAC Name | sodium;tetrakis[3,5-bis(trifluoromethyl)phenyl]boranuide |
| InChI Key | LTGMONZOZHXAHO-UHFFFAOYSA-N |
| Molecular Formula | C32H12BF24Na |
Benzoic anhydride, 98%
CAS: 93-97-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.231 MDL Number: MFCD00003073 InChI Key: CHIHQLCVLOXUJW-UHFFFAOYSA-N Synonym: benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate PubChem CID: 7167 ChEBI: CHEBI:38815 IUPAC Name: benzoyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2
| PubChem CID | 7167 |
|---|---|
| CAS | 93-97-0 |
| Molecular Weight (g/mol) | 226.231 |
| ChEBI | CHEBI:38815 |
| MDL Number | MFCD00003073 |
| SMILES | C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2 |
| Synonym | benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate |
| IUPAC Name | benzoyl benzoate |
| InChI Key | CHIHQLCVLOXUJW-UHFFFAOYSA-N |
| Molecular Formula | C14H10O3 |
Hydroquinone bis(2-hydroxyethyl) ether, 95%
CAS: 104-38-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.218 MDL Number: MFCD00002861 InChI Key: WTPYFJNYAMXZJG-UHFFFAOYSA-N Synonym: hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol PubChem CID: 66912 IUPAC Name: 2-[4-(2-hydroxyethoxy)phenoxy]ethanol SMILES: C1=CC(=CC=C1OCCO)OCCO
| PubChem CID | 66912 |
|---|---|
| CAS | 104-38-1 |
| Molecular Weight (g/mol) | 198.218 |
| MDL Number | MFCD00002861 |
| SMILES | C1=CC(=CC=C1OCCO)OCCO |
| Synonym | hydroquinone bis 2-hydroxyethyl ether,1,4-bis 2-hydroxyethoxy benzene,vernatzer 30/10,2,2'-1,4-phenylenebis oxy diethanol,hydroquinone di 2-hydroxyethyl ether,hydroquinone diethylol ether,2,2'-phenylenedioxy diethanol,2,2'-p-phenylenedioxy diethanol,2,2'-p-phenylenedioxydiethanol,2-4-2-hydroxyethoxy phenoxy ethanol |
| IUPAC Name | 2-[4-(2-hydroxyethoxy)phenoxy]ethanol |
| InChI Key | WTPYFJNYAMXZJG-UHFFFAOYSA-N |
| Molecular Formula | C10H14O4 |
Hippuric acid, 98%
CAS: 495-69-2 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.18 MDL Number: MFCD00002692 InChI Key: QIAFMBKCNZACKA-UHFFFAOYSA-N Synonym: hippuric acid,n-benzoylglycine,glycine, n-benzoyl,benzoylglycine,benzamidoacetic acid,benzoylaminoacetic acid,hippurate,hippursaeure,phenylcarbonylaminoacetic acid,benzamidoessigsaeure PubChem CID: 464 ChEBI: CHEBI:18089 SMILES: OC(=O)CNC(=O)C1=CC=CC=C1
| PubChem CID | 464 |
|---|---|
| CAS | 495-69-2 |
| Molecular Weight (g/mol) | 179.18 |
| ChEBI | CHEBI:18089 |
| MDL Number | MFCD00002692 |
| SMILES | OC(=O)CNC(=O)C1=CC=CC=C1 |
| Synonym | hippuric acid,n-benzoylglycine,glycine, n-benzoyl,benzoylglycine,benzamidoacetic acid,benzoylaminoacetic acid,hippurate,hippursaeure,phenylcarbonylaminoacetic acid,benzamidoessigsaeure |
| InChI Key | QIAFMBKCNZACKA-UHFFFAOYSA-N |
| Molecular Formula | C9H9NO3 |
Benzophenone, 99%
CAS: 119-61-9 Molecular Formula: C13H10O Molecular Weight (g/mol): 182.222 MDL Number: MFCD00003076 InChI Key: RWCCWEUUXYIKHB-UHFFFAOYSA-N Synonym: benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC Name: diphenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
| PubChem CID | 3102 |
|---|---|
| CAS | 119-61-9 |
| Molecular Weight (g/mol) | 182.222 |
| ChEBI | CHEBI:41308 |
| MDL Number | MFCD00003076 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| Synonym | benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone |
| IUPAC Name | diphenylmethanone |
| InChI Key | RWCCWEUUXYIKHB-UHFFFAOYSA-N |
| Molecular Formula | C13H10O |
Toluene-2,4-diisocyanate, tech. 80%, remainder 2,6-diisocyanate
CAS: 584-84-9 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002011 InChI Key: DVKJHBMWWAPEIU-UHFFFAOYSA-N Synonym: 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate PubChem CID: 11443 ChEBI: CHEBI:53556 IUPAC Name: 2,4-diisocyanato-1-methylbenzene SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O
| PubChem CID | 11443 |
|---|---|
| CAS | 584-84-9 |
| Molecular Weight (g/mol) | 174.159 |
| ChEBI | CHEBI:53556 |
| MDL Number | MFCD00002011 |
| SMILES | CC1=C(C=C(C=C1)N=C=O)N=C=O |
| Synonym | 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate |
| IUPAC Name | 2,4-diisocyanato-1-methylbenzene |
| InChI Key | DVKJHBMWWAPEIU-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2 |
1,4-Dimethoxybenzene, 98%
CAS: 150-78-7 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008401 InChI Key: OHBQPCCCRFSCAX-UHFFFAOYSA-N Synonym: p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 PubChem CID: 9016 IUPAC Name: 1,4-dimethoxybenzene SMILES: COC1=CC=C(OC)C=C1
| PubChem CID | 9016 |
|---|---|
| CAS | 150-78-7 |
| Molecular Weight (g/mol) | 138.17 |
| MDL Number | MFCD00008401 |
| SMILES | COC1=CC=C(OC)C=C1 |
| Synonym | p-dimethoxybenzene,p-methoxyanisole,hydroquinone dimethyl ether,benzene, 1,4-dimethoxy,quinol dimethyl ether,benzene, p-dimethoxy,dimethylhydroquinone ether,dimethyl ether hydroquinone,1,4-dimethoxybenzol,usaf an-9 |
| IUPAC Name | 1,4-dimethoxybenzene |
| InChI Key | OHBQPCCCRFSCAX-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
4-Bromobenzaldehyde, 99%
CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br
| PubChem CID | 70741 |
|---|---|
| CAS | 1122-91-4 |
| Molecular Weight (g/mol) | 185.02 |
| SMILES | C1=CC(=CC=C1C=O)Br |
| Synonym | p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd |
| IUPAC Name | 4-bromobenzaldehyde |
| InChI Key | ZRYZBQLXDKPBDU-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrO |
Cumene, 98%, pure
CAS: 98-82-8 MDL Number: MFCD00008881 InChI Key: RWGFKTVRMDUZSP-UHFFFAOYSA-N Synonym: isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano PubChem CID: 7406 ChEBI: CHEBI:34656 IUPAC Name: cumene SMILES: CC(C)C1=CC=CC=C1
| PubChem CID | 7406 |
|---|---|
| CAS | 98-82-8 |
| ChEBI | CHEBI:34656 |
| MDL Number | MFCD00008881 |
| SMILES | CC(C)C1=CC=CC=C1 |
| Synonym | isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano |
| IUPAC Name | cumene |
| InChI Key | RWGFKTVRMDUZSP-UHFFFAOYSA-N |