Benzene and substituted derivatives
Filtered Search Results
4-Isopropenyltoluene (stabilized with TBC) 95.0+%, TCI America™
CAS: 1195-32-0 Molecular Formula: C10H12 Molecular Weight (g/mol): 132.21 MDL Number: MFCD00036510 InChI Key: MMSLOZQEMPDGPI-UHFFFAOYSA-N Synonym: 1-methyl-4-prop-1-en-2-yl benzene,dehydro-p-cymene,2-p-tolylpropene,4-isopropenyltoluene,4-methylisopropenylbenzene,2-p-methylphenyl propene,p-cymenene,p,alpha-dimethylstyrene,p-alpha-dimethylstyrene,1-isopropenyl-4-methylbenzene PubChem CID: 62385 IUPAC Name: 1-methyl-4-(prop-1-en-2-yl)benzene SMILES: CC(=C)C1=CC=C(C)C=C1
| PubChem CID | 62385 |
|---|---|
| CAS | 1195-32-0 |
| Molecular Weight (g/mol) | 132.21 |
| MDL Number | MFCD00036510 |
| SMILES | CC(=C)C1=CC=C(C)C=C1 |
| Synonym | 1-methyl-4-prop-1-en-2-yl benzene,dehydro-p-cymene,2-p-tolylpropene,4-isopropenyltoluene,4-methylisopropenylbenzene,2-p-methylphenyl propene,p-cymenene,p,alpha-dimethylstyrene,p-alpha-dimethylstyrene,1-isopropenyl-4-methylbenzene |
| IUPAC Name | 1-methyl-4-(prop-1-en-2-yl)benzene |
| InChI Key | MMSLOZQEMPDGPI-UHFFFAOYSA-N |
| Molecular Formula | C10H12 |
4'-Hexyloxybenzylidene-4-cyanoaniline 98.0+%, TCI America™
CAS: 35280-78-5 Molecular Formula: C20H22N2O Molecular Weight (g/mol): 306.41 MDL Number: MFCD00059589 InChI Key: YABQOLANVLHEPV-UHFFFAOYSA-N PubChem CID: 118801 IUPAC Name: 4-({[4-(hexyloxy)phenyl]methylidene}amino)benzonitrile SMILES: CCCCCCOC1=CC=C(C=NC2=CC=C(C=C2)C#N)C=C1
| PubChem CID | 118801 |
|---|---|
| CAS | 35280-78-5 |
| Molecular Weight (g/mol) | 306.41 |
| MDL Number | MFCD00059589 |
| SMILES | CCCCCCOC1=CC=C(C=NC2=CC=C(C=C2)C#N)C=C1 |
| IUPAC Name | 4-({[4-(hexyloxy)phenyl]methylidene}amino)benzonitrile |
| InChI Key | YABQOLANVLHEPV-UHFFFAOYSA-N |
| Molecular Formula | C20H22N2O |
| PubChem CID | 2763244 |
|---|---|
| CAS | 313545-41-4 |
| Molecular Weight (g/mol) | 224.37 |
| MDL Number | MFCD04973086 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=C(C=C(C=C1)Cl)C(F)(F)F)(O)O |
| TSCA | No |
| IUPAC Name | [4-chloro-2-(trifluoromethyl)phenyl]boronic acid |
| InChI Key | YAPBOBGBYQQYHX-UHFFFAOYSA-N |
| Molecular Formula | C7H5BClF3O2 |
| Formula Weight | 224.37 |
| Melting Point | 182°C |
2'-Acetonaphthone 98.0+%, TCI America™
CAS: 93-08-3 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00004108 InChI Key: XSAYZAUNJMRRIR-UHFFFAOYSA-N Synonym: 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone PubChem CID: 7122 ChEBI: CHEBI:52364 IUPAC Name: 1-naphthalen-2-ylethanone SMILES: CC(=O)C1=CC2=CC=CC=C2C=C1
| PubChem CID | 7122 |
|---|---|
| CAS | 93-08-3 |
| Molecular Weight (g/mol) | 170.211 |
| ChEBI | CHEBI:52364 |
| MDL Number | MFCD00004108 |
| SMILES | CC(=O)C1=CC2=CC=CC=C2C=C1 |
| Synonym | 2-acetylnaphthalene,2-acetonaphthone,2'-acetonaphthone,methyl 2-naphthyl ketone,acetonaphthone,1-naphthalen-2-yl ethanone,1-2-naphthyl ethanone,ethanone, 1-2-naphthalenyl,oranger cyrstals,2-naphthyl methyl ketone |
| IUPAC Name | 1-naphthalen-2-ylethanone |
| InChI Key | XSAYZAUNJMRRIR-UHFFFAOYSA-N |
| Molecular Formula | C12H10O |
4-tert-Butylbenzyl Alcohol 97.0+%, TCI America™
CAS: 877-65-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 MDL Number: MFCD00004662 InChI Key: FVEINXLJOJPHLH-UHFFFAOYSA-N Synonym: 4-tert-butylbenzyl alcohol,4-tert-butyl phenyl methanol,4-tert-butylphenyl methanol,4-t-butylbenzyl alcohol,p-tert-butylbenzyl alcohol,4-t-butylbenzylalcohol,benzenemethanol, 4-1,1-dimethylethyl,4-1,1-dimethylethyl benzenemethanol,4-tert-butylbenzylalcohol,p-t-butylbenzyl alcohol PubChem CID: 13416 IUPAC Name: (4-tert-butylphenyl)methanol SMILES: CC(C)(C)C1=CC=C(C=C1)CO
| PubChem CID | 13416 |
|---|---|
| CAS | 877-65-6 |
| Molecular Weight (g/mol) | 164.248 |
| MDL Number | MFCD00004662 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)CO |
| Synonym | 4-tert-butylbenzyl alcohol,4-tert-butyl phenyl methanol,4-tert-butylphenyl methanol,4-t-butylbenzyl alcohol,p-tert-butylbenzyl alcohol,4-t-butylbenzylalcohol,benzenemethanol, 4-1,1-dimethylethyl,4-1,1-dimethylethyl benzenemethanol,4-tert-butylbenzylalcohol,p-t-butylbenzyl alcohol |
| IUPAC Name | (4-tert-butylphenyl)methanol |
| InChI Key | FVEINXLJOJPHLH-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
Phenyl Chloroformate 98.0+%, TCI America™
CAS: 1885-14-9 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.57 MDL Number: MFCD00000637 InChI Key: AHWALFGBDFAJAI-UHFFFAOYSA-N Synonym: phenyl chloroformate,chloroformic acid phenyl ester,phenyl chlorocarbonate,carbonochloridic acid, phenyl ester,phenoxycarbonyl chloride,formic acid, chloro-, phenyl ester,fenylester kyseliny chlormravenci,phenylchloroformate,unii-6tnd0d6d3y,6tnd0d6d3y PubChem CID: 15891 IUPAC Name: phenyl carbonochloridate SMILES: ClC(=O)OC1=CC=CC=C1
| PubChem CID | 15891 |
|---|---|
| CAS | 1885-14-9 |
| Molecular Weight (g/mol) | 156.57 |
| MDL Number | MFCD00000637 |
| SMILES | ClC(=O)OC1=CC=CC=C1 |
| Synonym | phenyl chloroformate,chloroformic acid phenyl ester,phenyl chlorocarbonate,carbonochloridic acid, phenyl ester,phenoxycarbonyl chloride,formic acid, chloro-, phenyl ester,fenylester kyseliny chlormravenci,phenylchloroformate,unii-6tnd0d6d3y,6tnd0d6d3y |
| IUPAC Name | phenyl carbonochloridate |
| InChI Key | AHWALFGBDFAJAI-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO2 |
Methyl 3,4-Dihydroxybenzoate 98.0+%, TCI America™
CAS: 2150-43-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00016437 InChI Key: CUFLZUDASVUNOE-UHFFFAOYSA-N Synonym: methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz PubChem CID: 287064 IUPAC Name: methyl 3,4-dihydroxybenzoate SMILES: COC(=O)C1=CC=C(O)C(O)=C1
| PubChem CID | 287064 |
|---|---|
| CAS | 2150-43-8 |
| Molecular Weight (g/mol) | 168.15 |
| MDL Number | MFCD00016437 |
| SMILES | COC(=O)C1=CC=C(O)C(O)=C1 |
| Synonym | methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz |
| IUPAC Name | methyl 3,4-dihydroxybenzoate |
| InChI Key | CUFLZUDASVUNOE-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |
| PubChem CID | 2734364 |
|---|---|
| CAS | 149104-88-1 |
| MDL Number | MFCD01630820 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| TSCA | No |
| InChI Key | VDUKDQTYMWUSAC-UHFFFAOYSA-N |
| Molecular Formula | C7H9BO4S |
| Formula Weight | 200.02 |
| Melting Point | 293°C |
Neopentylbenzene 97.0+%, TCI America™
CAS: 1007-26-7 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00038279 InChI Key: CJGXJKVMUHXVHL-UHFFFAOYSA-N Synonym: neopentylbenzene,benzene, 2,2-dimethylpropyl,neopentyl benzene,benzene, neopentyl,2,2-dimethyl-1-propyl benzene,unii-7mhd03e509,2,2-dimethylpropyl benzene,1-neopentylbenzene,acmc-1bs8x PubChem CID: 13877 IUPAC Name: 2,2-dimethylpropylbenzene SMILES: CC(C)(C)CC1=CC=CC=C1
| PubChem CID | 13877 |
|---|---|
| CAS | 1007-26-7 |
| Molecular Weight (g/mol) | 148.249 |
| MDL Number | MFCD00038279 |
| SMILES | CC(C)(C)CC1=CC=CC=C1 |
| Synonym | neopentylbenzene,benzene, 2,2-dimethylpropyl,neopentyl benzene,benzene, neopentyl,2,2-dimethyl-1-propyl benzene,unii-7mhd03e509,2,2-dimethylpropyl benzene,1-neopentylbenzene,acmc-1bs8x |
| IUPAC Name | 2,2-dimethylpropylbenzene |
| InChI Key | CJGXJKVMUHXVHL-UHFFFAOYSA-N |
| Molecular Formula | C11H16 |
5-Chloro-2-nitrobenzamide 90.0+%, TCI America™
CAS: 40763-96-0 Molecular Formula: C7H5ClN2O3 Molecular Weight (g/mol): 200.578 InChI Key: MKHXTOPPKVFSFI-UHFFFAOYSA-N Synonym: benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide PubChem CID: 2723672 IUPAC Name: 5-chloro-2-nitrobenzamide SMILES: C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-]
| PubChem CID | 2723672 |
|---|---|
| CAS | 40763-96-0 |
| Molecular Weight (g/mol) | 200.578 |
| SMILES | C1=CC(=C(C=C1Cl)C(=O)N)[N+](=O)[O-] |
| Synonym | benzamide, 5-chloro-2-nitro,acmc-209jgl,5-chloro-2-nitrobenzamid,2-nitro-5-chlorobenzamide,2-carbamoyl-4-chloronitrobenzene,5-chloro-2-nitrobenzamide |
| IUPAC Name | 5-chloro-2-nitrobenzamide |
| InChI Key | MKHXTOPPKVFSFI-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClN2O3 |
4-Methyl-3-nitrobenzonitrile 98.0+%, TCI America™
CAS: 939-79-7 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 MDL Number: MFCD00031482 InChI Key: KOFBNBCOGKLUOM-UHFFFAOYSA-N Synonym: 3-nitro-4-methylbenzonitrile,3-nitro-p-tolunitrile,4-methyl-3-nitro-benzonitrile,benzonitrile, 4-methyl-3-nitro,4-cyano-2-nitrotoluene,4-methyl-3-nitrobenzenecarbonitrile,5-cyano-2-methylnitrobenzene,2-nitro-p-toluonitrile,pubchem4817,acmc-209gtb PubChem CID: 589333 IUPAC Name: 4-methyl-3-nitrobenzonitrile SMILES: CC1=C(C=C(C=C1)C#N)[N+](=O)[O-]
| PubChem CID | 589333 |
|---|---|
| CAS | 939-79-7 |
| Molecular Weight (g/mol) | 162.148 |
| MDL Number | MFCD00031482 |
| SMILES | CC1=C(C=C(C=C1)C#N)[N+](=O)[O-] |
| Synonym | 3-nitro-4-methylbenzonitrile,3-nitro-p-tolunitrile,4-methyl-3-nitro-benzonitrile,benzonitrile, 4-methyl-3-nitro,4-cyano-2-nitrotoluene,4-methyl-3-nitrobenzenecarbonitrile,5-cyano-2-methylnitrobenzene,2-nitro-p-toluonitrile,pubchem4817,acmc-209gtb |
| IUPAC Name | 4-methyl-3-nitrobenzonitrile |
| InChI Key | KOFBNBCOGKLUOM-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O2 |
2-Bromo-4,5-dimethoxybenzoic Acid 98.0+%, TCI America™
CAS: 6286-46-0 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.07 MDL Number: MFCD00017542 InChI Key: HWFCHCRFQWEFMU-UHFFFAOYSA-N Synonym: 6-bromoveratric acid,benzoic acid, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxybenzoicacid,6-bromo-3,4-dimethoxybenzoic acid,6-bromveratrumsaure,acmc-1b7v8,ksc496e4l,rarechem al be 0015,timtec-bb sbb037916 PubChem CID: 222963 IUPAC Name: 2-bromo-4,5-dimethoxybenzoic acid SMILES: COC1=CC(Br)=C(C=C1OC)C(O)=O
| PubChem CID | 222963 |
|---|---|
| CAS | 6286-46-0 |
| Molecular Weight (g/mol) | 261.07 |
| MDL Number | MFCD00017542 |
| SMILES | COC1=CC(Br)=C(C=C1OC)C(O)=O |
| Synonym | 6-bromoveratric acid,benzoic acid, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxybenzoicacid,6-bromo-3,4-dimethoxybenzoic acid,6-bromveratrumsaure,acmc-1b7v8,ksc496e4l,rarechem al be 0015,timtec-bb sbb037916 |
| IUPAC Name | 2-bromo-4,5-dimethoxybenzoic acid |
| InChI Key | HWFCHCRFQWEFMU-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO4 |
4-Cyano-4'-ethoxybiphenyl 98.0+%, TCI America™
CAS: 58743-78-5 Molecular Formula: C15H13NO Molecular Weight (g/mol): 223.275 MDL Number: MFCD01218033 InChI Key: VETJRGXWDLHERN-UHFFFAOYSA-N Synonym: 4'-ethoxy-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-ethoxybiphenyl,4-ethoxy-4'-cyanobiphenyl,4-4-ethoxyphenyl benzonitrile,4-ethoxy-1,1'-biphenyl-4'-carbonitrile,1,1'-biphenyl-4-carbonitrile, 4'-ethoxy,4'-ethoxy-4-cyanobiphenyl,4-4-ethoxyphenyl benzenecarbonitrile,pubchem2524 PubChem CID: 93893 IUPAC Name: 4-(4-ethoxyphenyl)benzonitrile SMILES: CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 93893 |
|---|---|
| CAS | 58743-78-5 |
| Molecular Weight (g/mol) | 223.275 |
| MDL Number | MFCD01218033 |
| SMILES | CCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| Synonym | 4'-ethoxy-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-ethoxybiphenyl,4-ethoxy-4'-cyanobiphenyl,4-4-ethoxyphenyl benzonitrile,4-ethoxy-1,1'-biphenyl-4'-carbonitrile,1,1'-biphenyl-4-carbonitrile, 4'-ethoxy,4'-ethoxy-4-cyanobiphenyl,4-4-ethoxyphenyl benzenecarbonitrile,pubchem2524 |
| IUPAC Name | 4-(4-ethoxyphenyl)benzonitrile |
| InChI Key | VETJRGXWDLHERN-UHFFFAOYSA-N |
| Molecular Formula | C15H13NO |
4-Cyano-4'-hexylbiphenyl 98.0+%, TCI America™
CAS: 41122-70-7 Molecular Formula: C19H21N Molecular Weight (g/mol): 263.384 MDL Number: MFCD00075144 InChI Key: VADSDVGLFDVIMG-UHFFFAOYSA-N Synonym: 4-hexyl-4'-cyanobiphenyl,4-cyano-4'-hexylbiphenyl,4'-hexyl-4-biphenylcarbonitrile,4-n-hexyl-4'-cyanobiphenyl,4'-hexyl-1,1'-biphenyl-4-carbonitrile,4'-hexylbiphenyl-4-carbonitrile,ccris 6044,1,1'-biphenyl-4-carbonitrile, 4'-hexyl,4-4-hexylphenyl benzonitrile PubChem CID: 38764 IUPAC Name: 4-(4-hexylphenyl)benzonitrile SMILES: CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
| PubChem CID | 38764 |
|---|---|
| CAS | 41122-70-7 |
| Molecular Weight (g/mol) | 263.384 |
| MDL Number | MFCD00075144 |
| SMILES | CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N |
| Synonym | 4-hexyl-4'-cyanobiphenyl,4-cyano-4'-hexylbiphenyl,4'-hexyl-4-biphenylcarbonitrile,4-n-hexyl-4'-cyanobiphenyl,4'-hexyl-1,1'-biphenyl-4-carbonitrile,4'-hexylbiphenyl-4-carbonitrile,ccris 6044,1,1'-biphenyl-4-carbonitrile, 4'-hexyl,4-4-hexylphenyl benzonitrile |
| IUPAC Name | 4-(4-hexylphenyl)benzonitrile |
| InChI Key | VADSDVGLFDVIMG-UHFFFAOYSA-N |
| Molecular Formula | C19H21N |