3-Methyl-4-phenyl-1-pentene
TL;DR: 3-Methyl-4-phenyl-1-pentene (CAS 50871-04-0) 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-en-2-ylbenzene
Also Known As: 3-Methyl-4-phenyl-1-pentene, 3-methyl-4-phenylpent-1-ene, (1,2-Dimethyl-3-butenyl)benzene, (3-methylpent-4-en-2-yl)benzene, 3-methylpent-4-en-2-ylbenzene
| Molecular Formula | C12H16 |
|---|---|
| Molecular Weight | 160.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 160.1252 |
| Heavy Atoms | 12 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 50871-04-0 |
|---|---|
| SMILES | CC(C=C)C(C)C1=CC=CC=C1 |
| InChIKey | NAAPDMCWFLYJDA-UHFFFAOYSA-N |
Product Overview
3-Methyl-4-phenyl-1-pentene (CAS 50871-04-0), with molecular formula C12H16 and molecular weight 160.13 g/mol. IUPAC: 3-methylpent-4-en-2-ylbenzene.
Chemical Property Profile of 3-Methyl-4-phenyl-1-pentene
Property Insights of 3-Methyl-4-phenyl-1-pentene
The XLogP value of 3.9 indicates that 3-Methyl-4-phenyl-1-pentene 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-phenyl-1-pentene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-4-phenyl-1-pentene 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-phenyl-1-pentene?
The CAS number of 3-Methyl-4-phenyl-1-pentene is 50871-04-0.
What is the molecular formula of 3-Methyl-4-phenyl-1-pentene?
The molecular formula of 3-Methyl-4-phenyl-1-pentene is C12H16.
What is the molecular weight of 3-Methyl-4-phenyl-1-pentene?
The molecular weight of 3-Methyl-4-phenyl-1-pentene is 160.13 g/mol.
Where can I buy 3-Methyl-4-phenyl-1-pentene?
You can request a quote for 3-Methyl-4-phenyl-1-pentene 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-phenyl-1-pentene?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-4-phenyl-1-pentene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.