Benzene and substituted derivatives
Filtered Search Results
(S)-Glycidyl 4-Nitrobenzenesulfonate 98.0+%, TCI America™
CAS: 118712-60-0 Molecular Formula: C9H9NO6S Molecular Weight (g/mol): 259.232 MDL Number: MFCD08460170 InChI Key: CXYDYDCHYJXOEY-QMMMGPOBSA-N Synonym: 4-Nitrobenzenesulfonic Acid (S)-Glycidyl Ester PubChem CID: 10868995 IUPAC Name: [(2S)-oxiran-2-yl]methyl 4-nitrobenzenesulfonate SMILES: C1C(O1)COS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]
| PubChem CID | 10868995 |
|---|---|
| CAS | 118712-60-0 |
| Molecular Weight (g/mol) | 259.232 |
| MDL Number | MFCD08460170 |
| SMILES | C1C(O1)COS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| Synonym | 4-Nitrobenzenesulfonic Acid (S)-Glycidyl Ester |
| IUPAC Name | [(2S)-oxiran-2-yl]methyl 4-nitrobenzenesulfonate |
| InChI Key | CXYDYDCHYJXOEY-QMMMGPOBSA-N |
| Molecular Formula | C9H9NO6S |
2-Methoxyphenylhydrazine Hydrochloride 98.0+%, TCI America™
CAS: 6971-45-5 Molecular Formula: C7H11ClN2O Molecular Weight (g/mol): 174.628 MDL Number: MFCD00035456 InChI Key: HECSHXUNOVTAIJ-UHFFFAOYSA-N Synonym: 2-Hydrazinoanisole Hydrochloride PubChem CID: 2849445 IUPAC Name: (2-methoxyphenyl)hydrazine;hydrochloride SMILES: COC1=CC=CC=C1NN.Cl
| PubChem CID | 2849445 |
|---|---|
| CAS | 6971-45-5 |
| Molecular Weight (g/mol) | 174.628 |
| MDL Number | MFCD00035456 |
| SMILES | COC1=CC=CC=C1NN.Cl |
| Synonym | 2-Hydrazinoanisole Hydrochloride |
| IUPAC Name | (2-methoxyphenyl)hydrazine;hydrochloride |
| InChI Key | HECSHXUNOVTAIJ-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClN2O |
2-(Trifluoromethyl)benzal Chloride, TCI America™
CAS: 707-72-2 Molecular Formula: C8H5Cl2F3 Molecular Weight (g/mol): 229.02 MDL Number: MFCD00077613 InChI Key: JIJFXGFHPXLJME-UHFFFAOYSA-N PubChem CID: 606399 IUPAC Name: 1-(dichloromethyl)-2-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=CC=CC=C1C(Cl)Cl
| PubChem CID | 606399 |
|---|---|
| CAS | 707-72-2 |
| Molecular Weight (g/mol) | 229.02 |
| MDL Number | MFCD00077613 |
| SMILES | FC(F)(F)C1=CC=CC=C1C(Cl)Cl |
| IUPAC Name | 1-(dichloromethyl)-2-(trifluoromethyl)benzene |
| InChI Key | JIJFXGFHPXLJME-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2F3 |
1,3-Bis(2,6-diisopropylphenyl)imidazolidin-2-ylidene 98.0+%, TCI America™
CAS: 258278-28-3 Molecular Formula: C27H38N2 Molecular Weight (g/mol): 390.615 MDL Number: MFCD10567379 InChI Key: XZDYFCGKKKSOEY-UHFFFAOYSA-N Synonym: SIPr PubChem CID: 10883669 IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydro-2H-imidazol-1-ium-2-ide SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N2CC[N+](=[C-]2)C3=C(C=CC=C3C(C)C)C(C)C
| PubChem CID | 10883669 |
|---|---|
| CAS | 258278-28-3 |
| Molecular Weight (g/mol) | 390.615 |
| MDL Number | MFCD10567379 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(C)C)N2CC[N+](=[C-]2)C3=C(C=CC=C3C(C)C)C(C)C |
| Synonym | SIPr |
| IUPAC Name | 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydro-2H-imidazol-1-ium-2-ide |
| InChI Key | XZDYFCGKKKSOEY-UHFFFAOYSA-N |
| Molecular Formula | C27H38N2 |
2-(4-Bromophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 98.0+%, TCI America™
CAS: 68716-49-4 Molecular Formula: C12H16BBrO2 Molecular Weight (g/mol): 282.97 MDL Number: MFCD11110553 InChI Key: AZCNDGAXOZWQPV-UHFFFAOYSA-N Synonym: 1-Bromo-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, 4-Bromophenylboronic Acid Pinacol Ester PubChem CID: 10755376 IUPAC Name: 2-(4-bromophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(Br)C=C1
| PubChem CID | 10755376 |
|---|---|
| CAS | 68716-49-4 |
| Molecular Weight (g/mol) | 282.97 |
| MDL Number | MFCD11110553 |
| SMILES | CC1(C)OB(OC1(C)C)C1=CC=C(Br)C=C1 |
| Synonym | 1-Bromo-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, 4-Bromophenylboronic Acid Pinacol Ester |
| IUPAC Name | 2-(4-bromophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| InChI Key | AZCNDGAXOZWQPV-UHFFFAOYSA-N |
| Molecular Formula | C12H16BBrO2 |
1-(3-Fluorobenzyl)piperazine 98.0+%, TCI America™
CAS: 55513-19-4 Molecular Formula: C11H15FN2 Molecular Weight (g/mol): 194.253 MDL Number: MFCD02242870 InChI Key: ITHBJSRWFNLKIH-UHFFFAOYSA-N Synonym: 1-3-fluorobenzyl piperazine,1-3-fluorophenyl methyl piperazine,1-3-fluoro-benzyl-piperazine,3-fluorophenyl methyl piperazine,1-3-fluorobenz-yl piperazine,piperazine, 1-3-fluorophenyl methyl,1-3-fluorophenyl methyl piperazine trifluoroacetate PubChem CID: 903813 IUPAC Name: 1-[(3-fluorophenyl)methyl]piperazine SMILES: C1CN(CCN1)CC2=CC(=CC=C2)F
| PubChem CID | 903813 |
|---|---|
| CAS | 55513-19-4 |
| Molecular Weight (g/mol) | 194.253 |
| MDL Number | MFCD02242870 |
| SMILES | C1CN(CCN1)CC2=CC(=CC=C2)F |
| Synonym | 1-3-fluorobenzyl piperazine,1-3-fluorophenyl methyl piperazine,1-3-fluoro-benzyl-piperazine,3-fluorophenyl methyl piperazine,1-3-fluorobenz-yl piperazine,piperazine, 1-3-fluorophenyl methyl,1-3-fluorophenyl methyl piperazine trifluoroacetate |
| IUPAC Name | 1-[(3-fluorophenyl)methyl]piperazine |
| InChI Key | ITHBJSRWFNLKIH-UHFFFAOYSA-N |
| Molecular Formula | C11H15FN2 |
| PubChem CID | 22171291 |
|---|---|
| CAS | 603122-80-1 |
| MDL Number | MFCD08689530 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| Synonym | 2-Chloro-4-(methoxycarbonyl)benzeneboronic Acid |
| TSCA | No |
| InChI Key | ITEQHBSWRMYSRP-UHFFFAOYSA-N |
| Molecular Formula | C8H8BClO4 |
| Formula Weight | 214.41 |
1,3,5-Tris(3-bromophenyl)benzene 96.0+%, TCI America™
CAS: 96761-85-2 Molecular Formula: C24H15Br3 Molecular Weight (g/mol): 543.096 MDL Number: MFCD02323390 InChI Key: JKCQADHKVQXKFF-UHFFFAOYSA-N PubChem CID: 4576280 IUPAC Name: 1,3,5-tris(3-bromophenyl)benzene SMILES: C1=CC(=CC(=C1)Br)C2=CC(=CC(=C2)C3=CC(=CC=C3)Br)C4=CC(=CC=C4)Br
| PubChem CID | 4576280 |
|---|---|
| CAS | 96761-85-2 |
| Molecular Weight (g/mol) | 543.096 |
| MDL Number | MFCD02323390 |
| SMILES | C1=CC(=CC(=C1)Br)C2=CC(=CC(=C2)C3=CC(=CC=C3)Br)C4=CC(=CC=C4)Br |
| IUPAC Name | 1,3,5-tris(3-bromophenyl)benzene |
| InChI Key | JKCQADHKVQXKFF-UHFFFAOYSA-N |
| Molecular Formula | C24H15Br3 |
3,5-Difluorobenzonitrile 99.0+%, TCI America™
CAS: 64248-63-1 Molecular Formula: C7H3F2N Molecular Weight (g/mol): 139.11 MDL Number: MFCD00010311 InChI Key: CQXZSEXZQVKCHW-UHFFFAOYSA-N Synonym: benzonitrile, 3,5-difluoro,5-cyano-1,3-difluorobenzene,3,5-difluoro benzonitrile,3,5-difluoro-benzonitrile,3,5-difluorobenzenecarbonitrile,pubchem4761,3.5-difluorobenzonitrile,acmc-1bc3f,ksc355k7h,paragos 390210 PubChem CID: 587204 IUPAC Name: 3,5-difluorobenzonitrile SMILES: FC1=CC(=CC(F)=C1)C#N
| PubChem CID | 587204 |
|---|---|
| CAS | 64248-63-1 |
| Molecular Weight (g/mol) | 139.11 |
| MDL Number | MFCD00010311 |
| SMILES | FC1=CC(=CC(F)=C1)C#N |
| Synonym | benzonitrile, 3,5-difluoro,5-cyano-1,3-difluorobenzene,3,5-difluoro benzonitrile,3,5-difluoro-benzonitrile,3,5-difluorobenzenecarbonitrile,pubchem4761,3.5-difluorobenzonitrile,acmc-1bc3f,ksc355k7h,paragos 390210 |
| IUPAC Name | 3,5-difluorobenzonitrile |
| InChI Key | CQXZSEXZQVKCHW-UHFFFAOYSA-N |
| Molecular Formula | C7H3F2N |
Malachite Green, Oxalate 95.0+%, TCI America™
CAS: 2437-29-8 Molecular Formula: C52H54N4O12 Molecular Weight (g/mol): 927.02 MDL Number: MFCD00011766,MFCD00151209 InChI Key: CNYGFPPAGUCRIC-UHFFFAOYSA-L Synonym: malachite green oxalate,basic green 4,unii-gy1h9o33vu,gy1h9o33vu,malachite green, oxalate,dsstox_cid_5513,malachite green oxalate salt c.i. 42000,dsstox_rid_77817,dsstox_gsid_25513,n,n,n',n'-tetramethyl-4,4'-diaminotriphenylcarbenium oxalate PubChem CID: 2724411 IUPAC Name: bis(bis[4-(dimethylamino)phenyl](phenyl)methylium) oxalic acid dihydrogen oxalate SMILES: OC(=O)C(O)=O.OC(=O)C([O-])=O.OC(=O)C([O-])=O.CN(C)C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=C(C=C1)N(C)C.CN(C)C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=C(C=C1)N(C)C
| PubChem CID | 2724411 |
|---|---|
| CAS | 2437-29-8 |
| Molecular Weight (g/mol) | 927.02 |
| MDL Number | MFCD00011766,MFCD00151209 |
| SMILES | OC(=O)C(O)=O.OC(=O)C([O-])=O.OC(=O)C([O-])=O.CN(C)C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=C(C=C1)N(C)C.CN(C)C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=C(C=C1)N(C)C |
| Synonym | malachite green oxalate,basic green 4,unii-gy1h9o33vu,gy1h9o33vu,malachite green, oxalate,dsstox_cid_5513,malachite green oxalate salt c.i. 42000,dsstox_rid_77817,dsstox_gsid_25513,n,n,n',n'-tetramethyl-4,4'-diaminotriphenylcarbenium oxalate |
| IUPAC Name | bis(bis[4-(dimethylamino)phenyl](phenyl)methylium) oxalic acid dihydrogen oxalate |
| InChI Key | CNYGFPPAGUCRIC-UHFFFAOYSA-L |
| Molecular Formula | C52H54N4O12 |
4-Diethylaminobenzaldehyde 99.0+%, TCI America™
CAS: 120-21-8 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD00003382 InChI Key: MNFZZNNFORDXSV-UHFFFAOYSA-N Synonym: 4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde PubChem CID: 67114 ChEBI: CHEBI:86194 IUPAC Name: 4-(diethylamino)benzaldehyde SMILES: CCN(CC)C1=CC=C(C=C1)C=O
| PubChem CID | 67114 |
|---|---|
| CAS | 120-21-8 |
| Molecular Weight (g/mol) | 177.247 |
| ChEBI | CHEBI:86194 |
| MDL Number | MFCD00003382 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C=O |
| Synonym | 4-diethylamino benzaldehyde,benzaldehyde, 4-diethylamino,p-diethylamino benzaldehyde,p-formyl-n,n-diethylaniline,4-diethylamino-benzaldehyde,benzaldehyde, p-diethylamino,unii-s640xwl10h,p-n,n-diethylaminobenzaldehyde,p-diethylaminobenzaldehyde,4-n,n-diethylamino benzaldehyde |
| IUPAC Name | 4-(diethylamino)benzaldehyde |
| InChI Key | MNFZZNNFORDXSV-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO |
5'-Chloro-3-hydroxy-2',4'-dimethoxy-2-naphthanilide 98.0+%, TCI America™
CAS: 92-72-8 Molecular Formula: C19H16ClNO4 Molecular Weight (g/mol): 357.79 MDL Number: MFCD00021635 InChI Key: XDWATWCCUTYUDE-UHFFFAOYSA-N Synonym: N-(5-Chloro-2,4-dimethoxyphenyl)-3-hydroxy-2-naphthamide, Naphthol AS-ITR, Azoic Coupling Component 12 PubChem CID: 66714 IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide SMILES: COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl)OC
| PubChem CID | 66714 |
|---|---|
| CAS | 92-72-8 |
| Molecular Weight (g/mol) | 357.79 |
| MDL Number | MFCD00021635 |
| SMILES | COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl)OC |
| Synonym | N-(5-Chloro-2,4-dimethoxyphenyl)-3-hydroxy-2-naphthamide, Naphthol AS-ITR, Azoic Coupling Component 12 |
| IUPAC Name | N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide |
| InChI Key | XDWATWCCUTYUDE-UHFFFAOYSA-N |
| Molecular Formula | C19H16ClNO4 |
1,2-Dichloro-4-fluorobenzene 98.0+%, TCI America™
CAS: 1435-49-0 Molecular Formula: C6H3Cl2F Molecular Weight (g/mol): 164.99 MDL Number: MFCD00018119 InChI Key: QSDKXMVGRLVIQV-UHFFFAOYSA-N Synonym: 3,4-dichlorofluorobenzene,3,4-dichloro-1-fluorobenzene,benzene, 1,2-dichloro-4-fluoro,pubchem3453,3,4 dichlorofluorobenzene,acmc-1byo2,ksc494g9b,1,2-dichloro-4-fluoro-benzene PubChem CID: 74028 IUPAC Name: 1,2-dichloro-4-fluorobenzene SMILES: FC1=CC=C(Cl)C(Cl)=C1
| PubChem CID | 74028 |
|---|---|
| CAS | 1435-49-0 |
| Molecular Weight (g/mol) | 164.99 |
| MDL Number | MFCD00018119 |
| SMILES | FC1=CC=C(Cl)C(Cl)=C1 |
| Synonym | 3,4-dichlorofluorobenzene,3,4-dichloro-1-fluorobenzene,benzene, 1,2-dichloro-4-fluoro,pubchem3453,3,4 dichlorofluorobenzene,acmc-1byo2,ksc494g9b,1,2-dichloro-4-fluoro-benzene |
| IUPAC Name | 1,2-dichloro-4-fluorobenzene |
| InChI Key | QSDKXMVGRLVIQV-UHFFFAOYSA-N |
| Molecular Formula | C6H3Cl2F |
Trimethyl Orthobenzoate 95.0+%, TCI America™
CAS: 707-07-3 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00008474 InChI Key: IECKAVQTURBPON-UHFFFAOYSA-N Synonym: trimethyl orthobenzoate,trimethoxymethyl benzene,methyl orthobenzoate,benzene, trimethoxymethyl,trimethylorthobenzoate,orthobenzoic acid, trimethyl ester,orthobenzoic acid trimethyl ester,alpha,alpha,alpha-trimethoxytoluene,trimethoxyphenylmethane,trimethyl orthobeznoate PubChem CID: 69720 IUPAC Name: trimethoxymethylbenzene SMILES: COC(C1=CC=CC=C1)(OC)OC
| PubChem CID | 69720 |
|---|---|
| CAS | 707-07-3 |
| Molecular Weight (g/mol) | 182.219 |
| MDL Number | MFCD00008474 |
| SMILES | COC(C1=CC=CC=C1)(OC)OC |
| Synonym | trimethyl orthobenzoate,trimethoxymethyl benzene,methyl orthobenzoate,benzene, trimethoxymethyl,trimethylorthobenzoate,orthobenzoic acid, trimethyl ester,orthobenzoic acid trimethyl ester,alpha,alpha,alpha-trimethoxytoluene,trimethoxyphenylmethane,trimethyl orthobeznoate |
| IUPAC Name | trimethoxymethylbenzene |
| InChI Key | IECKAVQTURBPON-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3 |
5-Bromo-1,2,3-trimethoxybenzene 98.0+%, TCI America™
CAS: 2675-79-8 Molecular Formula: C9H11BrO3 Molecular Weight (g/mol): 247.09 MDL Number: MFCD00017169 InChI Key: XAOOZMATJDXDQJ-UHFFFAOYSA-N Synonym: 1-bromo-3,4,5-trimethoxybenzene,3,4,5-trimethoxybromobenzene,bromotrimethoxybenzene,benzene, 5-bromo-1,2,3-trimethoxy,5-bromo-1,2,3-trimethoxy-benzene,pubchem10980,3,4,5-trimethoxybromoben,ksc490o1d,3,4,5-trimethoxyphenylbromide,3,4,5-triemethoxyphenylbromide PubChem CID: 75885 IUPAC Name: 5-bromo-1,2,3-trimethoxybenzene SMILES: COC1=CC(Br)=CC(OC)=C1OC
| PubChem CID | 75885 |
|---|---|
| CAS | 2675-79-8 |
| Molecular Weight (g/mol) | 247.09 |
| MDL Number | MFCD00017169 |
| SMILES | COC1=CC(Br)=CC(OC)=C1OC |
| Synonym | 1-bromo-3,4,5-trimethoxybenzene,3,4,5-trimethoxybromobenzene,bromotrimethoxybenzene,benzene, 5-bromo-1,2,3-trimethoxy,5-bromo-1,2,3-trimethoxy-benzene,pubchem10980,3,4,5-trimethoxybromoben,ksc490o1d,3,4,5-trimethoxyphenylbromide,3,4,5-triemethoxyphenylbromide |
| IUPAC Name | 5-bromo-1,2,3-trimethoxybenzene |
| InChI Key | XAOOZMATJDXDQJ-UHFFFAOYSA-N |
| Molecular Formula | C9H11BrO3 |