Benzene and substituted derivatives
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1,4-Dipropylbenzene 97.0+%, TCI America™
CAS: 4815-57-0 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD03844789 InChI Key: PHUANMGFAOCUOQ-UHFFFAOYSA-N PubChem CID: 20958 IUPAC Name: 1,4-dipropylbenzene SMILES: CCCC1=CC=C(C=C1)CCC
| PubChem CID | 20958 |
|---|---|
| CAS | 4815-57-0 |
| Molecular Weight (g/mol) | 162.276 |
| MDL Number | MFCD03844789 |
| SMILES | CCCC1=CC=C(C=C1)CCC |
| IUPAC Name | 1,4-dipropylbenzene |
| InChI Key | PHUANMGFAOCUOQ-UHFFFAOYSA-N |
| Molecular Formula | C12H18 |
1-Bromo-3,5-di-tert-butylbenzene 98.0+%, TCI America™
CAS: 22385-77-9 Molecular Formula: C14H21Br Molecular Weight (g/mol): 269.226 MDL Number: MFCD00796945 InChI Key: BUOWTUULDKULFI-UHFFFAOYSA-N Synonym: 1-bromo-3,5-di-tert-butylbenzene,3,5-di-tert-butylbromobenzene,3,5-di-t-butylbromobenzene,1-bromo-3,5-di-t-butylbenzene,1-bromo-3,5-ditert-butyl benzene,benzene, 1-bromo-3,5-bis 1,1-dimethylethyl,1,5-bis tert-butyl-3-bromobenzene,acmc-1cpbo,g00018-watson-int,3,5-di-t-butyl-bromobenzene PubChem CID: 620136 IUPAC Name: 1-bromo-3,5-ditert-butylbenzene SMILES: CC(C)(C)C1=CC(=CC(=C1)Br)C(C)(C)C
| PubChem CID | 620136 |
|---|---|
| CAS | 22385-77-9 |
| Molecular Weight (g/mol) | 269.226 |
| MDL Number | MFCD00796945 |
| SMILES | CC(C)(C)C1=CC(=CC(=C1)Br)C(C)(C)C |
| Synonym | 1-bromo-3,5-di-tert-butylbenzene,3,5-di-tert-butylbromobenzene,3,5-di-t-butylbromobenzene,1-bromo-3,5-di-t-butylbenzene,1-bromo-3,5-ditert-butyl benzene,benzene, 1-bromo-3,5-bis 1,1-dimethylethyl,1,5-bis tert-butyl-3-bromobenzene,acmc-1cpbo,g00018-watson-int,3,5-di-t-butyl-bromobenzene |
| IUPAC Name | 1-bromo-3,5-ditert-butylbenzene |
| InChI Key | BUOWTUULDKULFI-UHFFFAOYSA-N |
| Molecular Formula | C14H21Br |
2-Bromo-4-tert-butylphenol 97.0+%, TCI America™
CAS: 2198-66-5 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.117 MDL Number: MFCD02682891 InChI Key: FFRLMQPMGIMHHQ-UHFFFAOYSA-N PubChem CID: 75147 IUPAC Name: 2-bromo-4-tert-butylphenol SMILES: CC(C)(C)C1=CC(=C(C=C1)O)Br
| PubChem CID | 75147 |
|---|---|
| CAS | 2198-66-5 |
| Molecular Weight (g/mol) | 229.117 |
| MDL Number | MFCD02682891 |
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)Br |
| IUPAC Name | 2-bromo-4-tert-butylphenol |
| InChI Key | FFRLMQPMGIMHHQ-UHFFFAOYSA-N |
| Molecular Formula | C10H13BrO |
2-tert-Amylphenol 98.0+%, TCI America™
CAS: 3279-27-4 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 InChI Key: BGRKGHSKCFAPCL-UHFFFAOYSA-N Synonym: 2-(1,1-Dimethylpropyl)phenol, 2-tert-Pentylphenol PubChem CID: 76769 IUPAC Name: 2-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=CC=C1O
| PubChem CID | 76769 |
|---|---|
| CAS | 3279-27-4 |
| Molecular Weight (g/mol) | 164.248 |
| SMILES | CCC(C)(C)C1=CC=CC=C1O |
| Synonym | 2-(1,1-Dimethylpropyl)phenol, 2-tert-Pentylphenol |
| IUPAC Name | 2-(2-methylbutan-2-yl)phenol |
| InChI Key | BGRKGHSKCFAPCL-UHFFFAOYSA-N |
| Molecular Formula | C11H16O |
trans-2,6-Diisopropyl-N-(2-pyridylmethylene)aniline 95.0+%, TCI America™
CAS: 908294-68-8 Molecular Formula: C18H22N2 Molecular Weight (g/mol): 266.39 MDL Number: MFCD06669887 InChI Key: BABQFMPURPKJNW-UHFFFAOYSA-N PubChem CID: 1284716 IUPAC Name: N-[2,6-bis(propan-2-yl)phenyl]-1-(pyridin-2-yl)methanimine SMILES: CC(C)C1=CC=CC(C(C)C)=C1N=CC1=CC=CC=N1
| PubChem CID | 1284716 |
|---|---|
| CAS | 908294-68-8 |
| Molecular Weight (g/mol) | 266.39 |
| MDL Number | MFCD06669887 |
| SMILES | CC(C)C1=CC=CC(C(C)C)=C1N=CC1=CC=CC=N1 |
| IUPAC Name | N-[2,6-bis(propan-2-yl)phenyl]-1-(pyridin-2-yl)methanimine |
| InChI Key | BABQFMPURPKJNW-UHFFFAOYSA-N |
| Molecular Formula | C18H22N2 |
| PubChem CID | 2773480 |
|---|---|
| CAS | 16152-51-5 |
| Molecular Weight (g/mol) | 164.011 |
| MDL Number | MFCD01074614 |
| Color | White-Yellow |
| Physical Form | Crystalline Powder |
| SMILES | B(C1=CC=C(C=C1)C(C)C)(O)O |
| TSCA | No |
| IUPAC Name | (4-propan-2-ylphenyl)boronic acid |
| InChI Key | IAEUFBDMVKQCLU-UHFFFAOYSA-N |
| Molecular Formula | C9H13BO2 |
| Formula Weight | 164.01 |
| Melting Point | 140°C |
4-Bromocumene 97.0+%, TCI America™
CAS: 586-61-8 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.09 MDL Number: MFCD00039159 InChI Key: MOZHUOIQYVYEPN-UHFFFAOYSA-N Synonym: 1-bromo-4-isopropylbenzene,4-bromocumene,4-bromoisopropylbenzene,p-bromocumene,4-isopropylbromobenzene,benzene, 1-bromo-4-1-methylethyl,p-bromoisopropylbenzene,2-p-bromophenyl propane,cumene, p-bromo,2-4-bromophenyl propane PubChem CID: 11462 IUPAC Name: 1-bromo-4-(propan-2-yl)benzene SMILES: CC(C)C1=CC=C(Br)C=C1
| PubChem CID | 11462 |
|---|---|
| CAS | 586-61-8 |
| Molecular Weight (g/mol) | 199.09 |
| MDL Number | MFCD00039159 |
| SMILES | CC(C)C1=CC=C(Br)C=C1 |
| Synonym | 1-bromo-4-isopropylbenzene,4-bromocumene,4-bromoisopropylbenzene,p-bromocumene,4-isopropylbromobenzene,benzene, 1-bromo-4-1-methylethyl,p-bromoisopropylbenzene,2-p-bromophenyl propane,cumene, p-bromo,2-4-bromophenyl propane |
| IUPAC Name | 1-bromo-4-(propan-2-yl)benzene |
| InChI Key | MOZHUOIQYVYEPN-UHFFFAOYSA-N |
| Molecular Formula | C9H11Br |
(S)-(-)-1-Phenyl-1-propanol 98.0+%, TCI America™
CAS: 613-87-6 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00066207 InChI Key: DYUQAZSOFZSPHD-UHFFFAOYNA-N Synonym: s---1-phenyl-1-propanol,s-1-phenylpropan-1-ol,1s-1-phenylpropan-1-ol,s-1-phenyl-1-propanol,s---1-phenylpropanol,s-1-phenyl-propan-1-ol,s---,a-ethylbenzyl alcohol,--s-1-phenyl-1-propanol;,s---alpha-ethylbenzyl alcohol PubChem CID: 2734864 IUPAC Name: 1-phenylpropan-1-ol SMILES: CCC(O)C1=CC=CC=C1
| PubChem CID | 2734864 |
|---|---|
| CAS | 613-87-6 |
| Molecular Weight (g/mol) | 136.19 |
| MDL Number | MFCD00066207 |
| SMILES | CCC(O)C1=CC=CC=C1 |
| Synonym | s---1-phenyl-1-propanol,s-1-phenylpropan-1-ol,1s-1-phenylpropan-1-ol,s-1-phenyl-1-propanol,s---1-phenylpropanol,s-1-phenyl-propan-1-ol,s---,a-ethylbenzyl alcohol,--s-1-phenyl-1-propanol;,s---alpha-ethylbenzyl alcohol |
| IUPAC Name | 1-phenylpropan-1-ol |
| InChI Key | DYUQAZSOFZSPHD-UHFFFAOYNA-N |
| Molecular Formula | C9H12O |
2,5-Di-tert-amylhydroquinone 93.0+%, TCI America™
CAS: 79-74-3 Molecular Formula: C16H26O2 Molecular Weight (g/mol): 250.38 MDL Number: MFCD00027029 InChI Key: CZNRFEXEPBITDS-UHFFFAOYSA-N Synonym: 2,5-Di-tert-pentylhydroquinone PubChem CID: 6610 IUPAC Name: 2,5-bis(2-methylbutan-2-yl)benzene-1,4-diol SMILES: CCC(C)(C)C1=CC(O)=C(C=C1O)C(C)(C)CC
| PubChem CID | 6610 |
|---|---|
| CAS | 79-74-3 |
| Molecular Weight (g/mol) | 250.38 |
| MDL Number | MFCD00027029 |
| SMILES | CCC(C)(C)C1=CC(O)=C(C=C1O)C(C)(C)CC |
| Synonym | 2,5-Di-tert-pentylhydroquinone |
| IUPAC Name | 2,5-bis(2-methylbutan-2-yl)benzene-1,4-diol |
| InChI Key | CZNRFEXEPBITDS-UHFFFAOYSA-N |
| Molecular Formula | C16H26O2 |
2-Propylaniline 98.0+%, TCI America™
CAS: 1821-39-2 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00009803 InChI Key: WKURVXXDGMYSDP-UHFFFAOYSA-N PubChem CID: 15759 IUPAC Name: 2-propylaniline SMILES: CCCC1=CC=CC=C1N
| PubChem CID | 15759 |
|---|---|
| CAS | 1821-39-2 |
| Molecular Weight (g/mol) | 135.21 |
| MDL Number | MFCD00009803 |
| SMILES | CCCC1=CC=CC=C1N |
| IUPAC Name | 2-propylaniline |
| InChI Key | WKURVXXDGMYSDP-UHFFFAOYSA-N |
| Molecular Formula | C9H13N |
4-Bromo-2-tert-butylphenol 95.0+%, TCI America™
CAS: 10323-39-4 Molecular Formula: C10H13BrO Molecular Weight (g/mol): 229.12 MDL Number: MFCD00192645 InChI Key: IKMJSWBFODAWTC-UHFFFAOYSA-N PubChem CID: 97068 IUPAC Name: 4-bromo-2-tert-butylphenol SMILES: CC(C)(C)C1=CC(Br)=CC=C1O
| PubChem CID | 97068 |
|---|---|
| CAS | 10323-39-4 |
| Molecular Weight (g/mol) | 229.12 |
| MDL Number | MFCD00192645 |
| SMILES | CC(C)(C)C1=CC(Br)=CC=C1O |
| IUPAC Name | 4-bromo-2-tert-butylphenol |
| InChI Key | IKMJSWBFODAWTC-UHFFFAOYSA-N |
| Molecular Formula | C10H13BrO |
2,6-Diisopropylaniline 90.0+%, TCI America™
CAS: 24544-04-5 Molecular Formula: C12H19N Molecular Weight (g/mol): 177.291 MDL Number: MFCD00008887 InChI Key: WKBALTUBRZPIPZ-UHFFFAOYSA-N Synonym: 2,6-diisopropylaniline,benzenamine, 2,6-bis 1-methylethyl,2,6-diisopropyl aniline,aniline, 2,6-diisopropyl,diisopropylaniline,2,6-diisopropylphenylamine,2,6-bis propan-2-yl aniline,2,6-dilsopropylaniline,2,6-di propan-2-yl aniline,2,6-bis 1-methylethyl aniline PubChem CID: 32484 IUPAC Name: 2,6-di(propan-2-yl)aniline SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N
| PubChem CID | 32484 |
|---|---|
| CAS | 24544-04-5 |
| Molecular Weight (g/mol) | 177.291 |
| MDL Number | MFCD00008887 |
| SMILES | CC(C)C1=C(C(=CC=C1)C(C)C)N |
| Synonym | 2,6-diisopropylaniline,benzenamine, 2,6-bis 1-methylethyl,2,6-diisopropyl aniline,aniline, 2,6-diisopropyl,diisopropylaniline,2,6-diisopropylphenylamine,2,6-bis propan-2-yl aniline,2,6-dilsopropylaniline,2,6-di propan-2-yl aniline,2,6-bis 1-methylethyl aniline |
| IUPAC Name | 2,6-di(propan-2-yl)aniline |
| InChI Key | WKBALTUBRZPIPZ-UHFFFAOYSA-N |
| Molecular Formula | C12H19N |
m-Cymene 99.0+%, TCI America™
CAS: 535-77-3 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00008891 InChI Key: XCYJPXQACVEIOS-UHFFFAOYSA-N Synonym: m-cymene,1-isopropyl-3-methylbenzene,3-isopropyltoluene,m-isopropyltoluene,m-cymol,m-methylisopropylbenzene,beta-cymene,benzene, 1-methyl-3-1-methylethyl,1-methyl-3-isopropylbenzene,1-methyl-3-1-methylethyl benzene PubChem CID: 10812 IUPAC Name: 1-methyl-3-(propan-2-yl)benzene SMILES: CC(C)C1=CC=CC(C)=C1
| PubChem CID | 10812 |
|---|---|
| CAS | 535-77-3 |
| Molecular Weight (g/mol) | 134.22 |
| MDL Number | MFCD00008891 |
| SMILES | CC(C)C1=CC=CC(C)=C1 |
| Synonym | m-cymene,1-isopropyl-3-methylbenzene,3-isopropyltoluene,m-isopropyltoluene,m-cymol,m-methylisopropylbenzene,beta-cymene,benzene, 1-methyl-3-1-methylethyl,1-methyl-3-isopropylbenzene,1-methyl-3-1-methylethyl benzene |
| IUPAC Name | 1-methyl-3-(propan-2-yl)benzene |
| InChI Key | XCYJPXQACVEIOS-UHFFFAOYSA-N |
| Molecular Formula | C10H14 |
1,3-Diisopropylbenzene 85.0+%, TCI America™
CAS: 99-62-7 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00008889 InChI Key: UNEATYXSUBPPKP-UHFFFAOYSA-N Synonym: 1,3-diisopropylbenzene,m-diisopropylbenzene,benzene, 1,3-bis 1-methylethyl,benzene, m-diisopropyl,m-diisopropylbenzol,1,3-bis 1-methylethyl benzene,3-isopropylcumene,unii-482vxw192e,meta-diisopropylbenzene,chembl31352 PubChem CID: 7450 IUPAC Name: 1,3-di(propan-2-yl)benzene SMILES: CC(C)C1=CC(=CC=C1)C(C)C
| PubChem CID | 7450 |
|---|---|
| CAS | 99-62-7 |
| Molecular Weight (g/mol) | 162.276 |
| MDL Number | MFCD00008889 |
| SMILES | CC(C)C1=CC(=CC=C1)C(C)C |
| Synonym | 1,3-diisopropylbenzene,m-diisopropylbenzene,benzene, 1,3-bis 1-methylethyl,benzene, m-diisopropyl,m-diisopropylbenzol,1,3-bis 1-methylethyl benzene,3-isopropylcumene,unii-482vxw192e,meta-diisopropylbenzene,chembl31352 |
| IUPAC Name | 1,3-di(propan-2-yl)benzene |
| InChI Key | UNEATYXSUBPPKP-UHFFFAOYSA-N |
| Molecular Formula | C12H18 |