(3-Methyl-4-pentenyl)benzene
TL;DR: (3-Methyl-4-pentenyl)benzene (CAS 42524-30-1) 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.
3-methylpent-4-enylbenzene
Also Known As: (3-Methyl-4-pentenyl)benzene, 3-methylpent-4-enylbenzene, 3-Methyl-5-phenyl-1-pentene, 3-methyl-pent-4-enyl-benzene, Benzene, (3-methyl-4-pentenyl)-
| Molecular Formula | C12H16 |
|---|---|
| Molecular Weight | 160.13 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.1252 |
| Heavy Atoms | 12 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 42524-30-1 |
|---|---|
| SMILES | CC(CCC1=CC=CC=C1)C=C |
| InChIKey | RECDVQPZVWBGII-UHFFFAOYSA-N |
Product Overview
(3-Methyl-4-pentenyl)benzene (CAS 42524-30-1), with molecular formula C12H16 and molecular weight 160.13 g/mol. IUPAC: 3-methylpent-4-enylbenzene.
Chemical Property Profile of (3-Methyl-4-pentenyl)benzene
Property Insights of (3-Methyl-4-pentenyl)benzene
The XLogP value of 4.2 indicates that (3-Methyl-4-pentenyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (3-Methyl-4-pentenyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Methyl-4-pentenyl)benzene 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 (3-Methyl-4-pentenyl)benzene?
The CAS number of (3-Methyl-4-pentenyl)benzene is 42524-30-1.
What is the molecular formula of (3-Methyl-4-pentenyl)benzene?
The molecular formula of (3-Methyl-4-pentenyl)benzene is C12H16.
What is the molecular weight of (3-Methyl-4-pentenyl)benzene?
The molecular weight of (3-Methyl-4-pentenyl)benzene is 160.13 g/mol.
Where can I buy (3-Methyl-4-pentenyl)benzene?
You can request a quote for (3-Methyl-4-pentenyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methyl-4-pentenyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (3-Methyl-4-pentenyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.