Benzene and substituted derivatives
Filtered Search Results
4-sec-Butylphenol 98.0+%, TCI America™
CAS: 99-71-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002375 InChI Key: ZUTYZAFDFLLILI-UHFFFAOYSA-N PubChem CID: 7453 ChEBI: CHEBI:34442 IUPAC Name: 4-butan-2-ylphenol SMILES: CCC(C)C1=CC=C(C=C1)O
| PubChem CID | 7453 |
|---|---|
| CAS | 99-71-8 |
| Molecular Weight (g/mol) | 150.221 |
| ChEBI | CHEBI:34442 |
| MDL Number | MFCD00002375 |
| SMILES | CCC(C)C1=CC=C(C=C1)O |
| IUPAC Name | 4-butan-2-ylphenol |
| InChI Key | ZUTYZAFDFLLILI-UHFFFAOYSA-N |
| Molecular Formula | C10H14O |
3,5-Di-tert-butylbenzaldehyde 97.0+%, TCI America™
CAS: 17610-00-3 Molecular Formula: C15H22O Molecular Weight (g/mol): 218.34 MDL Number: MFCD00026298 InChI Key: BRUITYMDHWNCIG-UHFFFAOYSA-N Synonym: 3,5-di-tert-butylbenzaldehyde,3,5-bis tert-butyl benzaldehyde,3,5-di-t-butylbenzaldehyde,3,5-bis tert-butyl-1-formylbenzene,benzaldehyde, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butyl-benzaldehyde,acmc-20ai73,3,5-di-tertbutylbenzaldehyde,ksc181g1d,3,5-di-tert butylbenzaldehyde PubChem CID: 1268253 IUPAC Name: 3,5-di-tert-butylbenzaldehyde SMILES: CC(C)(C)C1=CC(=CC(C=O)=C1)C(C)(C)C
| PubChem CID | 1268253 |
|---|---|
| CAS | 17610-00-3 |
| Molecular Weight (g/mol) | 218.34 |
| MDL Number | MFCD00026298 |
| SMILES | CC(C)(C)C1=CC(=CC(C=O)=C1)C(C)(C)C |
| Synonym | 3,5-di-tert-butylbenzaldehyde,3,5-bis tert-butyl benzaldehyde,3,5-di-t-butylbenzaldehyde,3,5-bis tert-butyl-1-formylbenzene,benzaldehyde, 3,5-bis 1,1-dimethylethyl,3,5-di-tert-butyl-benzaldehyde,acmc-20ai73,3,5-di-tertbutylbenzaldehyde,ksc181g1d,3,5-di-tert butylbenzaldehyde |
| IUPAC Name | 3,5-di-tert-butylbenzaldehyde |
| InChI Key | BRUITYMDHWNCIG-UHFFFAOYSA-N |
| Molecular Formula | C15H22O |
4-Chlorophenylacetone 97.0+%, TCI America™
CAS: 5586-88-9 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00045214 InChI Key: WEJRYKSUUFKMBC-UHFFFAOYSA-N Synonym: 4-chlorophenylacetone,1-4-chlorophenyl acetone,1-4-chlorophenyl propan-2-one,1-p-chlorophenyl acetone,1-4-chloro-phenyl-propan-2-one,p-chlorophenyl acetone,2-propanone, 1-4-chlorophenyl,p-chlorophenylacetone,4-chlorophenyl acetone PubChem CID: 79699 IUPAC Name: 1-(4-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(Cl)C=C1
| PubChem CID | 79699 |
|---|---|
| CAS | 5586-88-9 |
| Molecular Weight (g/mol) | 168.62 |
| MDL Number | MFCD00045214 |
| SMILES | CC(=O)CC1=CC=C(Cl)C=C1 |
| Synonym | 4-chlorophenylacetone,1-4-chlorophenyl acetone,1-4-chlorophenyl propan-2-one,1-p-chlorophenyl acetone,1-4-chloro-phenyl-propan-2-one,p-chlorophenyl acetone,2-propanone, 1-4-chlorophenyl,p-chlorophenylacetone,4-chlorophenyl acetone |
| IUPAC Name | 1-(4-chlorophenyl)propan-2-one |
| InChI Key | WEJRYKSUUFKMBC-UHFFFAOYSA-N |
| Molecular Formula | C9H9ClO |
2-(5-tert-Butyl-2-hydroxyphenyl)benzotriazole 98.0+%, TCI America™
CAS: 3147-76-0 Molecular Formula: C16H17N3O Molecular Weight (g/mol): 267.332 MDL Number: MFCD03844795 InChI Key: WXHVQMGINBSVAY-UHFFFAOYSA-N PubChem CID: 76605 IUPAC Name: 2-(benzotriazol-2-yl)-4-tert-butylphenol SMILES: CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2
| PubChem CID | 76605 |
|---|---|
| CAS | 3147-76-0 |
| Molecular Weight (g/mol) | 267.332 |
| MDL Number | MFCD03844795 |
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2 |
| IUPAC Name | 2-(benzotriazol-2-yl)-4-tert-butylphenol |
| InChI Key | WXHVQMGINBSVAY-UHFFFAOYSA-N |
| Molecular Formula | C16H17N3O |
3-tert-Butyl-5-ethyltoluene 98.0+%, TCI America™
CAS: 6630-01-9 Molecular Formula: C13H20 Molecular Weight (g/mol): 176.30 MDL Number: MFCD00026954 InChI Key: URDKTSKLGNWKDB-UHFFFAOYSA-N PubChem CID: 23114 IUPAC Name: 1-tert-butyl-3-ethyl-5-methylbenzene SMILES: CCC1=CC(=CC(=C1)C)C(C)(C)C
| PubChem CID | 23114 |
|---|---|
| CAS | 6630-01-9 |
| Molecular Weight (g/mol) | 176.30 |
| MDL Number | MFCD00026954 |
| SMILES | CCC1=CC(=CC(=C1)C)C(C)(C)C |
| IUPAC Name | 1-tert-butyl-3-ethyl-5-methylbenzene |
| InChI Key | URDKTSKLGNWKDB-UHFFFAOYSA-N |
| Molecular Formula | C13H20 |
Monoethyl 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate 96.0+%, TCI America™
CAS: 66165-37-5 Molecular Formula: C17H29O4P Molecular Weight (g/mol): 328.39 MDL Number: MFCD06797098 InChI Key: WBSRIXCTCFFHEF-UHFFFAOYNA-N Synonym: 3,5-Di-tert-butyl-4-hydroxybenzylphosphonic Acid Monoethyl Ester, Ethyl Hydrogen 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate PubChem CID: 92274 IUPAC Name: [(3,5-di-tert-butyl-4-hydroxyphenyl)methyl](ethoxy)phosphinic acid SMILES: CCOP(O)(=O)CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
| PubChem CID | 92274 |
|---|---|
| CAS | 66165-37-5 |
| Molecular Weight (g/mol) | 328.39 |
| MDL Number | MFCD06797098 |
| SMILES | CCOP(O)(=O)CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C |
| Synonym | 3,5-Di-tert-butyl-4-hydroxybenzylphosphonic Acid Monoethyl Ester, Ethyl Hydrogen 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate |
| IUPAC Name | [(3,5-di-tert-butyl-4-hydroxyphenyl)methyl](ethoxy)phosphinic acid |
| InChI Key | WBSRIXCTCFFHEF-UHFFFAOYNA-N |
| Molecular Formula | C17H29O4P |
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 |
4-sec-Butylaniline 98.0+%, TCI America™
CAS: 30273-11-1 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.24 MDL Number: MFCD00010223 InChI Key: NVVVQTNTLIAISI-UHFFFAOYNA-N PubChem CID: 121771 IUPAC Name: 4-(butan-2-yl)aniline SMILES: CCC(C)C1=CC=C(N)C=C1
| PubChem CID | 121771 |
|---|---|
| CAS | 30273-11-1 |
| Molecular Weight (g/mol) | 149.24 |
| MDL Number | MFCD00010223 |
| SMILES | CCC(C)C1=CC=C(N)C=C1 |
| IUPAC Name | 4-(butan-2-yl)aniline |
| InChI Key | NVVVQTNTLIAISI-UHFFFAOYNA-N |
| Molecular Formula | C10H15N |
3-(4-tert-Butylphenyl)isobutyraldehyde 96.0+%, TCI America™
CAS: 80-54-6 Molecular Formula: C14H20O Molecular Weight (g/mol): 204.31 MDL Number: MFCD00047655 InChI Key: SDQFDHOLCGWZPU-UHFFFAOYNA-N Synonym: lilial,3-4-tert-butyl phenyl-2-methylpropanal,3-4-tert-butylphenyl isobutyraldehyde,lilyal,lily aldehyde,3-4-tert-butylphenyl-2-methylpropanal,3-4-tert-butylphenyl-2-methylpropionaldehyde,benzenepropanal, 4-1,1-dimethylethyl-.alpha.-methyl,butylphenyl methylpropional,2-4-tert-butylbenzyl propionaldehyde PubChem CID: 228987 IUPAC Name: 3-(4-tert-butylphenyl)-2-methylpropanal SMILES: CC(CC1=CC=C(C=C1)C(C)(C)C)C=O
| PubChem CID | 228987 |
|---|---|
| CAS | 80-54-6 |
| Molecular Weight (g/mol) | 204.31 |
| MDL Number | MFCD00047655 |
| SMILES | CC(CC1=CC=C(C=C1)C(C)(C)C)C=O |
| Synonym | lilial,3-4-tert-butyl phenyl-2-methylpropanal,3-4-tert-butylphenyl isobutyraldehyde,lilyal,lily aldehyde,3-4-tert-butylphenyl-2-methylpropanal,3-4-tert-butylphenyl-2-methylpropionaldehyde,benzenepropanal, 4-1,1-dimethylethyl-.alpha.-methyl,butylphenyl methylpropional,2-4-tert-butylbenzyl propionaldehyde |
| IUPAC Name | 3-(4-tert-butylphenyl)-2-methylpropanal |
| InChI Key | SDQFDHOLCGWZPU-UHFFFAOYNA-N |
| Molecular Formula | C14H20O |
Hexestrol 98.0+%, TCI America™
CAS: 84-16-2 Molecular Formula: C18H22O2 Molecular Weight (g/mol): 270.37 MDL Number: MFCD00068996 InChI Key: PBBGSZCBWVPOOL-UHFFFAOYNA-N Synonym: hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar PubChem CID: 192197 IUPAC Name: 4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol SMILES: CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
| PubChem CID | 192197 |
|---|---|
| CAS | 84-16-2 |
| Molecular Weight (g/mol) | 270.37 |
| MDL Number | MFCD00068996 |
| SMILES | CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1 |
| Synonym | hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar |
| IUPAC Name | 4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol |
| InChI Key | PBBGSZCBWVPOOL-UHFFFAOYNA-N |
| Molecular Formula | C18H22O2 |
3,4-Dimethoxyphenylacetone 97.0+%, TCI America™
CAS: 776-99-8 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008772 InChI Key: UMYZWICEDUEWIM-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone PubChem CID: 69896 IUPAC Name: 1-(3,4-dimethoxyphenyl)propan-2-one SMILES: COC1=CC=C(CC(C)=O)C=C1OC
| PubChem CID | 69896 |
|---|---|
| CAS | 776-99-8 |
| Molecular Weight (g/mol) | 194.23 |
| MDL Number | MFCD00008772 |
| SMILES | COC1=CC=C(CC(C)=O)C=C1OC |
| Synonym | 3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone |
| IUPAC Name | 1-(3,4-dimethoxyphenyl)propan-2-one |
| InChI Key | UMYZWICEDUEWIM-UHFFFAOYSA-N |
| Molecular Formula | C11H14O3 |
4-tert-Butyl-o-xylene 98.0+%, TCI America™
CAS: 7397-06-0 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00038277 InChI Key: QRPPSTNABSMSCS-UHFFFAOYSA-N Synonym: 4-tert-butyl-o-xylene,4-tert-butyl-1,2-dimethylbenzene,4-t-butyl-o-xylene,benzene, 4-1,1-dimethylethyl-1,2-dimethyl,acmc-209ot4,o-xylene, 4-tert-butyl,as-p2,1,2-dimethyl-4-t-butylbenzene,3,4-dimethyl-tert-butylbenzene PubChem CID: 81881 IUPAC Name: 4-tert-butyl-1,2-dimethylbenzene SMILES: CC1=C(C=C(C=C1)C(C)(C)C)C
| PubChem CID | 81881 |
|---|---|
| CAS | 7397-06-0 |
| Molecular Weight (g/mol) | 162.276 |
| MDL Number | MFCD00038277 |
| SMILES | CC1=C(C=C(C=C1)C(C)(C)C)C |
| Synonym | 4-tert-butyl-o-xylene,4-tert-butyl-1,2-dimethylbenzene,4-t-butyl-o-xylene,benzene, 4-1,1-dimethylethyl-1,2-dimethyl,acmc-209ot4,o-xylene, 4-tert-butyl,as-p2,1,2-dimethyl-4-t-butylbenzene,3,4-dimethyl-tert-butylbenzene |
| IUPAC Name | 4-tert-butyl-1,2-dimethylbenzene |
| InChI Key | QRPPSTNABSMSCS-UHFFFAOYSA-N |
| Molecular Formula | C12H18 |
6-tert-Butyl-o-cresol 99.0+%, TCI America™
CAS: 2219-82-1 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002239 InChI Key: BKZXZGWHTRCFPX-UHFFFAOYSA-N Synonym: 2-tert-Butyl-6-methylphenol PubChem CID: 16678 IUPAC Name: 2-tert-butyl-6-methylphenol SMILES: CC1=CC=CC(=C1O)C(C)(C)C
| PubChem CID | 16678 |
|---|---|
| CAS | 2219-82-1 |
| Molecular Weight (g/mol) | 164.25 |
| MDL Number | MFCD00002239 |
| SMILES | CC1=CC=CC(=C1O)C(C)(C)C |
| Synonym | 2-tert-Butyl-6-methylphenol |
| IUPAC Name | 2-tert-butyl-6-methylphenol |
| InChI Key | BKZXZGWHTRCFPX-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
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 |
| PubChem CID | 2734320 |
|---|---|
| CAS | 123324-71-0 |
| MDL Number | MFCD01009697 |
| Physical Form | Crystalline Powder |
| TSCA | No |
| IUPAC Name | (4-tert-butylphenyl)boronic acid |
| InChI Key | MNJYZNVROSZZQC-UHFFFAOYSA-N |
| Molecular Formula | C10H15BO2 |
| Formula Weight | 178.04 |
| Melting Point | 184°C |