Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-
TL;DR: Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- (CAS 70303-25-2) is a chemical compound with molecular formula C12H16 and molecular weight 160.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-propan-2-yl-2-prop-1-en-2-ylbenzene
Also Known As: Isopropylisopropenylbenzene, o-Isopropyl-alpha-methylstyrene, Styrene, o-isopropyl-.alpha.-methyl-, 1-Isopropenyl-2-isopropylbenzene, 1-Isopropenyl-2-isopropylbenzene #
| Molecular Formula | C12H16 |
|---|---|
| Molecular Weight | 160.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 160.1252 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 70303-25-2 |
|---|---|
| SMILES | CC(C)C1=CC=CC=C1C(=C)C |
| InChIKey | NQNOSJUXYMZTTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- (CAS 70303-25-2), with molecular formula C12H16 and molecular weight 160.13 g/mol. IUPAC: 1-propan-2-yl-2-prop-1-en-2-ylbenzene.
Chemical Property Profile of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-
Property Insights of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-
The XLogP value of 4.4 indicates that Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-?
The CAS number of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- is 70303-25-2.
What is the molecular formula of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-?
The molecular formula of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- is C12H16.
What is the molecular weight of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-?
The molecular weight of Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- is 160.13 g/mol.
Where can I buy Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-?
You can request a quote for Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-(1-methylethenyl)-2-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.