Benzene and substituted derivatives
Filtered Search Results
m-(4-Fluorophenoxy)toluene 97.0+%, TCI America™
CAS: 1514-26-7 Molecular Formula: C13H11FO Molecular Weight (g/mol): 202.228 MDL Number: MFCD01321168 InChI Key: APVQRVSBMIDSFS-UHFFFAOYSA-N Synonym: 4-Fluoro-3′C-methyldiphenyl Ether, 4-Fluorophenyl m-Tolyl Ether PubChem CID: 20068801 IUPAC Name: 1-fluoro-4-(3-methylphenoxy)benzene SMILES: CC1=CC(=CC=C1)OC2=CC=C(C=C2)F
| PubChem CID | 20068801 |
|---|---|
| CAS | 1514-26-7 |
| Molecular Weight (g/mol) | 202.228 |
| MDL Number | MFCD01321168 |
| SMILES | CC1=CC(=CC=C1)OC2=CC=C(C=C2)F |
| Synonym | 4-Fluoro-3′C-methyldiphenyl Ether, 4-Fluorophenyl m-Tolyl Ether |
| IUPAC Name | 1-fluoro-4-(3-methylphenoxy)benzene |
| InChI Key | APVQRVSBMIDSFS-UHFFFAOYSA-N |
| Molecular Formula | C13H11FO |
Ethyl O-Mesitylsulfonylacetohydroxamate 98.0+%, TCI America™
CAS: 38202-27-6 Molecular Formula: C13H19NO4S Molecular Weight (g/mol): 285.358 MDL Number: MFCD00009244 InChI Key: KQCBSWBQAXTILK-WYMLVPIESA-N Synonym: ethyl o-mesitylsulfonylacetohydroxamate,ethyl n-mesitylsulfonyl oxyacetimidate,ethyl o-methylsulphonylacetohydroxamate,ethyl o-2-mesitylenesulfonyl acethydroxamate,o-mesitylsulfonylacetohydroxamic acid ethyl ester,ethyl 1z-n-mesitylsulfonyl oxy ethanimidoate,ethyl 1e-n-2,4,6-trimethylphenyl sulfonyloxyethanimidate,kqcbswbqaxtilk-owbhpgmisa-n,z-ethyl n-mesitylsulfonyloxyacetimidate,z-ethyl n-mesitylsulfonyl oxyacetimidate PubChem CID: 6282444 IUPAC Name: ethyl (1E)-N-(2,4,6-trimethylphenyl)sulfonyloxyethanimidate SMILES: CCOC(=NOS(=O)(=O)C1=C(C=C(C=C1C)C)C)C
| PubChem CID | 6282444 |
|---|---|
| CAS | 38202-27-6 |
| Molecular Weight (g/mol) | 285.358 |
| MDL Number | MFCD00009244 |
| SMILES | CCOC(=NOS(=O)(=O)C1=C(C=C(C=C1C)C)C)C |
| Synonym | ethyl o-mesitylsulfonylacetohydroxamate,ethyl n-mesitylsulfonyl oxyacetimidate,ethyl o-methylsulphonylacetohydroxamate,ethyl o-2-mesitylenesulfonyl acethydroxamate,o-mesitylsulfonylacetohydroxamic acid ethyl ester,ethyl 1z-n-mesitylsulfonyl oxy ethanimidoate,ethyl 1e-n-2,4,6-trimethylphenyl sulfonyloxyethanimidate,kqcbswbqaxtilk-owbhpgmisa-n,z-ethyl n-mesitylsulfonyloxyacetimidate,z-ethyl n-mesitylsulfonyl oxyacetimidate |
| IUPAC Name | ethyl (1E)-N-(2,4,6-trimethylphenyl)sulfonyloxyethanimidate |
| InChI Key | KQCBSWBQAXTILK-WYMLVPIESA-N |
| Molecular Formula | C13H19NO4S |
2,3,4-Trimethoxybenzaldehyde 98.0+%, TCI America™
CAS: 2103-57-3 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 MDL Number: MFCD00003310 InChI Key: UCTUXUGXIFRVGX-UHFFFAOYSA-N Synonym: trimethoxybenzaldehyde,benzaldehyde, 2,3,4-trimethoxy,2,3,4-trimethoxy-benzaldehyde,benzaldehyde, trimethoxy,2,3,4 trimethoxybenzylaldehyde,pubchem8261,trimethoxy benzaldehyde,trimetazidine impurity c,acmc-1b07v,ksc201q5r PubChem CID: 75006 IUPAC Name: 2,3,4-trimethoxybenzaldehyde SMILES: COC1=C(C(=C(C=C1)C=O)OC)OC
| PubChem CID | 75006 |
|---|---|
| CAS | 2103-57-3 |
| Molecular Weight (g/mol) | 196.202 |
| MDL Number | MFCD00003310 |
| SMILES | COC1=C(C(=C(C=C1)C=O)OC)OC |
| Synonym | trimethoxybenzaldehyde,benzaldehyde, 2,3,4-trimethoxy,2,3,4-trimethoxy-benzaldehyde,benzaldehyde, trimethoxy,2,3,4 trimethoxybenzylaldehyde,pubchem8261,trimethoxy benzaldehyde,trimetazidine impurity c,acmc-1b07v,ksc201q5r |
| IUPAC Name | 2,3,4-trimethoxybenzaldehyde |
| InChI Key | UCTUXUGXIFRVGX-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
Sulfalene 98.0+%, TCI America™
CAS: 152-47-6 Molecular Formula: C11H12N4O3S Molecular Weight (g/mol): 280.302 MDL Number: MFCD00437754 InChI Key: KXRZBTAEDBELFD-UHFFFAOYSA-N Synonym: 4-Amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide, N-(3-Methoxypyrazin-2-yl)sulfanilamide PubChem CID: 9047 ChEBI: CHEBI:32162 IUPAC Name: 4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide SMILES: COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N
| PubChem CID | 9047 |
|---|---|
| CAS | 152-47-6 |
| Molecular Weight (g/mol) | 280.302 |
| ChEBI | CHEBI:32162 |
| MDL Number | MFCD00437754 |
| SMILES | COC1=NC=CN=C1NS(=O)(=O)C2=CC=C(C=C2)N |
| Synonym | 4-Amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide, N-(3-Methoxypyrazin-2-yl)sulfanilamide |
| IUPAC Name | 4-amino-N-(3-methoxypyrazin-2-yl)benzenesulfonamide |
| InChI Key | KXRZBTAEDBELFD-UHFFFAOYSA-N |
| Molecular Formula | C11H12N4O3S |
Methyl 3-Nitrobenzoate 98.0+%, TCI America™
CAS: 618-95-1 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007250 InChI Key: AXLYJLKKPUICKV-UHFFFAOYSA-N Synonym: 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate PubChem CID: 69260 IUPAC Name: methyl 3-nitrobenzoate SMILES: COC(=O)C1=CC(=CC=C1)[N+](=O)[O-]
| PubChem CID | 69260 |
|---|---|
| CAS | 618-95-1 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00007250 |
| SMILES | COC(=O)C1=CC(=CC=C1)[N+](=O)[O-] |
| Synonym | 3-nitrobenzoic acid methyl ester,methyl m-nitrobenzoate,methyl3-nitrobenzoate,benzoic acid, 3-nitro-, methyl ester,m-nitrobenzoic acid, methyl ester,benzoic acid, m-nitro-, methyl ester,3-nitro-benzoic acid methyl ester,3-nitro-benzoicacimethylester,acmc-209mxc,methyl 3-nitro-benzoate |
| IUPAC Name | methyl 3-nitrobenzoate |
| InChI Key | AXLYJLKKPUICKV-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Methyl 4-Methoxy-2-methylbenzoate 98.0+%, TCI America™
CAS: 35598-05-1 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD06203918 InChI Key: OGYAVWKYDVBIMW-UHFFFAOYSA-N Synonym: 4-Methoxy-2-methylbenzoic Acid Methyl Ester, Methyl 4-Methoxy-o-toluate, 4-Methoxy-o-toluic Acid Methyl Ester, Methyl 2-Methyl-p-anisate, 2-Methyl-p-anisic Acid Methyl Ester PubChem CID: 13257269 IUPAC Name: methyl 4-methoxy-2-methylbenzoate SMILES: COC(=O)C1=C(C)C=C(OC)C=C1
| PubChem CID | 13257269 |
|---|---|
| CAS | 35598-05-1 |
| Molecular Weight (g/mol) | 180.20 |
| MDL Number | MFCD06203918 |
| SMILES | COC(=O)C1=C(C)C=C(OC)C=C1 |
| Synonym | 4-Methoxy-2-methylbenzoic Acid Methyl Ester, Methyl 4-Methoxy-o-toluate, 4-Methoxy-o-toluic Acid Methyl Ester, Methyl 2-Methyl-p-anisate, 2-Methyl-p-anisic Acid Methyl Ester |
| IUPAC Name | methyl 4-methoxy-2-methylbenzoate |
| InChI Key | OGYAVWKYDVBIMW-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
4-(4-Hydroxy-3-methoxyphenyl)-2-butanone 98.0+%, TCI America™
CAS: 122-48-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00048232 InChI Key: OJYLAHXKWMRDGS-UHFFFAOYSA-N Synonym: zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl PubChem CID: 31211 ChEBI: CHEBI:68657 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC(=C(C=C1)O)OC
| PubChem CID | 31211 |
|---|---|
| CAS | 122-48-5 |
| Molecular Weight (g/mol) | 194.23 |
| ChEBI | CHEBI:68657 |
| MDL Number | MFCD00048232 |
| SMILES | CC(=O)CCC1=CC(=C(C=C1)O)OC |
| Synonym | zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl |
| IUPAC Name | 4-(4-hydroxy-3-methoxyphenyl)butan-2-one |
| InChI Key | OJYLAHXKWMRDGS-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
3-Chloromethyl-5-nitrosalicylaldehyde 97.0+%, TCI America™
CAS: 16644-30-7 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.59 MDL Number: MFCD00191331 InChI Key: VPZKJFJWKLYFQD-UHFFFAOYSA-N PubChem CID: 99380 IUPAC Name: 3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde SMILES: OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O
| PubChem CID | 99380 |
|---|---|
| CAS | 16644-30-7 |
| Molecular Weight (g/mol) | 215.59 |
| MDL Number | MFCD00191331 |
| SMILES | OC1=C(CCl)C=C(C=C1C=O)[N+]([O-])=O |
| IUPAC Name | 3-(chloromethyl)-2-hydroxy-5-nitrobenzaldehyde |
| InChI Key | VPZKJFJWKLYFQD-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4 |
2-Fluorobenzyl Alcohol 97.0+%, TCI America™
CAS: 446-51-5 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00004601 InChI Key: QEHXDOJPVIHUDO-UHFFFAOYSA-N Synonym: 2-fluorobenzyl alcohol,2-fluorophenyl methanol,o-fluorobenzyl alcohol,benzenemethanol, 2-fluoro,2-fluorobenzylalcohol,2-fluoro-benzenemethanol,2-fluorobenzylic alcohol,2-fluorophenyl methan-1-ol,pubchem3485,acmc-1asq8 PubChem CID: 67969 IUPAC Name: (2-fluorophenyl)methanol SMILES: OCC1=CC=CC=C1F
| PubChem CID | 67969 |
|---|---|
| CAS | 446-51-5 |
| Molecular Weight (g/mol) | 126.13 |
| MDL Number | MFCD00004601 |
| SMILES | OCC1=CC=CC=C1F |
| Synonym | 2-fluorobenzyl alcohol,2-fluorophenyl methanol,o-fluorobenzyl alcohol,benzenemethanol, 2-fluoro,2-fluorobenzylalcohol,2-fluoro-benzenemethanol,2-fluorobenzylic alcohol,2-fluorophenyl methan-1-ol,pubchem3485,acmc-1asq8 |
| IUPAC Name | (2-fluorophenyl)methanol |
| InChI Key | QEHXDOJPVIHUDO-UHFFFAOYSA-N |
| Molecular Formula | C7H7FO |
Diisodecyl Phthalate (mixture of branched chain isomers), TCI America™
CAS: 26761-40-0 Molecular Formula: C28H46O4 Molecular Weight (g/mol): 446.672 MDL Number: MFCD00048389 InChI Key: ZVFDTKUVRCTHQE-UHFFFAOYSA-N Synonym: Phthalic Acid Diisodecyl Ester, DIDP PubChem CID: 33599 ChEBI: CHEBI:34709 IUPAC Name: bis(8-methylnonyl) benzene-1,2-dicarboxylate SMILES: CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C
| PubChem CID | 33599 |
|---|---|
| CAS | 26761-40-0 |
| Molecular Weight (g/mol) | 446.672 |
| ChEBI | CHEBI:34709 |
| MDL Number | MFCD00048389 |
| SMILES | CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C |
| Synonym | Phthalic Acid Diisodecyl Ester, DIDP |
| IUPAC Name | bis(8-methylnonyl) benzene-1,2-dicarboxylate |
| InChI Key | ZVFDTKUVRCTHQE-UHFFFAOYSA-N |
| Molecular Formula | C28H46O4 |
2-Fluorobenzoic Acid 98.0+%, TCI America™
CAS: 445-29-4 Molecular Formula: C7H5FO2 Molecular Weight (g/mol): 140.113 MDL Number: MFCD00002405 InChI Key: NSTREUWFTAOOKS-UHFFFAOYSA-N Synonym: o-fluorobenzoic acid,benzoic acid, 2-fluoro,ortho-fluorobenzoic acid,o-fluorbenzoesaeure,benzoic acid, o-fluoro,fluorobenzoic acid,unii-64uz32koo4,o-fluorbenzoesaeure german,ofba,2-fluoro-benzoic acid PubChem CID: 9935 ChEBI: CHEBI:19577 IUPAC Name: 2-fluorobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)F
| PubChem CID | 9935 |
|---|---|
| CAS | 445-29-4 |
| Molecular Weight (g/mol) | 140.113 |
| ChEBI | CHEBI:19577 |
| MDL Number | MFCD00002405 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)F |
| Synonym | o-fluorobenzoic acid,benzoic acid, 2-fluoro,ortho-fluorobenzoic acid,o-fluorbenzoesaeure,benzoic acid, o-fluoro,fluorobenzoic acid,unii-64uz32koo4,o-fluorbenzoesaeure german,ofba,2-fluoro-benzoic acid |
| IUPAC Name | 2-fluorobenzoic acid |
| InChI Key | NSTREUWFTAOOKS-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO2 |
Ponceau SX, TCI America™
CAS: 4548-53-2 Molecular Formula: C18H14N2Na2O7S2 Molecular Weight (g/mol): 480.417 MDL Number: MFCD00046402 InChI Key: GRRDBTDTMCTWQZ-ZAWKPCBGSA-L Synonym: ponceau sx,c.i. food red 1,ponceau sx lake,4r purple,crimson 4r,maple ponceau sx,purple 4r,food red 1,hexacol ponceau sx,fd & c red no. 4 PubChem CID: 9595288 IUPAC Name: disodium;(3E)-3-[(2,4-dimethyl-5-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonate SMILES: CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+]
| PubChem CID | 9595288 |
|---|---|
| CAS | 4548-53-2 |
| Molecular Weight (g/mol) | 480.417 |
| MDL Number | MFCD00046402 |
| SMILES | CC1=CC(=C(C=C1NN=C2C=C(C3=CC=CC=C3C2=O)S(=O)(=O)[O-])S(=O)(=O)[O-])C.[Na+].[Na+] |
| Synonym | ponceau sx,c.i. food red 1,ponceau sx lake,4r purple,crimson 4r,maple ponceau sx,purple 4r,food red 1,hexacol ponceau sx,fd & c red no. 4 |
| IUPAC Name | disodium;(3E)-3-[(2,4-dimethyl-5-sulfonatophenyl)hydrazinylidene]-4-oxonaphthalene-1-sulfonate |
| InChI Key | GRRDBTDTMCTWQZ-ZAWKPCBGSA-L |
| Molecular Formula | C18H14N2Na2O7S2 |
Sodium p-Toluenesulfonate 90.0+%, TCI America™
CAS: 657-84-1 Molecular Formula: C7H7NaO3S Molecular Weight (g/mol): 194.18 MDL Number: MFCD00798566,MFCD00064388 InChI Key: KVCGISUBCHHTDD-UHFFFAOYSA-M Synonym: sodium p-toluenesulfonate,sodium 4-methylbenzenesulfonate,sodium tosylate,p-toluenesulfonic acid sodium salt,sodium toluenesulfonate,sodium toluenesulphonate,tosylate, sodium,naxonate hydrotrope,cyclophil sts 70,eltesol st 34 PubChem CID: 3720192 IUPAC Name: sodium 4-methylbenzene-1-sulfonate SMILES: [Na+].CC1=CC=C(C=C1)S([O-])(=O)=O
| PubChem CID | 3720192 |
|---|---|
| CAS | 657-84-1 |
| Molecular Weight (g/mol) | 194.18 |
| MDL Number | MFCD00798566,MFCD00064388 |
| SMILES | [Na+].CC1=CC=C(C=C1)S([O-])(=O)=O |
| Synonym | sodium p-toluenesulfonate,sodium 4-methylbenzenesulfonate,sodium tosylate,p-toluenesulfonic acid sodium salt,sodium toluenesulfonate,sodium toluenesulphonate,tosylate, sodium,naxonate hydrotrope,cyclophil sts 70,eltesol st 34 |
| IUPAC Name | sodium 4-methylbenzene-1-sulfonate |
| InChI Key | KVCGISUBCHHTDD-UHFFFAOYSA-M |
| Molecular Formula | C7H7NaO3S |
3-(Trifluoromethyl)benzyl Bromide 98.0+%, TCI America™
CAS: 402-23-3 Molecular Formula: C8H6BrF3 Molecular Weight (g/mol): 239.04 MDL Number: MFCD00000395 InChI Key: MYYYZNVAUZVXBO-UHFFFAOYSA-N Synonym: 3-trifluoromethyl benzyl bromide,1-bromomethyl-3-trifluoromethyl benzene,m-trifluoromethylbenzyl bromide,3-trifluoromethylbenzyl bromide,3-bromomethyl benzotrifluoride,3-trifluoromethylbenzylbromide,3-trifluoromethyl benzylbromide,1-bromomethyl-3-trifluoromethyl-benzene,alpha'-bromo-alpha,alpha,alpha-trifluoro-m-xylene PubChem CID: 123061 IUPAC Name: 1-(bromomethyl)-3-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=CC(CBr)=C1
| PubChem CID | 123061 |
|---|---|
| CAS | 402-23-3 |
| Molecular Weight (g/mol) | 239.04 |
| MDL Number | MFCD00000395 |
| SMILES | FC(F)(F)C1=CC=CC(CBr)=C1 |
| Synonym | 3-trifluoromethyl benzyl bromide,1-bromomethyl-3-trifluoromethyl benzene,m-trifluoromethylbenzyl bromide,3-trifluoromethylbenzyl bromide,3-bromomethyl benzotrifluoride,3-trifluoromethylbenzylbromide,3-trifluoromethyl benzylbromide,1-bromomethyl-3-trifluoromethyl-benzene,alpha'-bromo-alpha,alpha,alpha-trifluoro-m-xylene |
| IUPAC Name | 1-(bromomethyl)-3-(trifluoromethyl)benzene |
| InChI Key | MYYYZNVAUZVXBO-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrF3 |
alpha-Bromodiphenylmethane 97.0+%, TCI America™
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 |