(2-Methyl-1-butenyl)benzene
TL;DR: (2-Methyl-1-butenyl)benzene (CAS 7302-03-6) is a chemical compound with molecular formula C11H14 and molecular weight 146.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbut-1-enylbenzene
Also Known As: 2-Methyl-1-phenyl-1-butene, (2-methyl-1-butenyl)benzene, (2,3-dimethyl-1-propenyl)benzene, Benzene,(2-methyl-1-buten-1-yl)-, Benzene, [(1E)-2-methyl-1-butenyl]-
| Molecular Formula | C11H14 |
|---|---|
| Molecular Weight | 146.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 146.10954 |
| Heavy Atoms | 11 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 7302-03-6 |
|---|---|
| SMILES | CCC(=CC1=CC=CC=C1)C |
| InChIKey | OQYUFQVPURDFKC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2-Methyl-1-butenyl)benzene (CAS 7302-03-6), with molecular formula C11H14 and molecular weight 146.11 g/mol. IUPAC: 2-methylbut-1-enylbenzene.
Chemical Property Profile of (2-Methyl-1-butenyl)benzene
Property Insights of (2-Methyl-1-butenyl)benzene
The XLogP value of 4.0 indicates that (2-Methyl-1-butenyl)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, (2-Methyl-1-butenyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Methyl-1-butenyl)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 (2-Methyl-1-butenyl)benzene?
The CAS number of (2-Methyl-1-butenyl)benzene is 7302-03-6.
What is the molecular formula of (2-Methyl-1-butenyl)benzene?
The molecular formula of (2-Methyl-1-butenyl)benzene is C11H14.
What is the molecular weight of (2-Methyl-1-butenyl)benzene?
The molecular weight of (2-Methyl-1-butenyl)benzene is 146.11 g/mol.
Where can I buy (2-Methyl-1-butenyl)benzene?
You can request a quote for (2-Methyl-1-butenyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methyl-1-butenyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (2-Methyl-1-butenyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.