Allylcyclohexane
TL;DR: Allylcyclohexane (CAS 2114-42-3) is a chemical compound with molecular formula C9H16 and molecular weight 124.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enylcyclohexane
Also Known As: Allylcyclohexane, prop-2-enylcyclohexane, allyl-cyclohexane, Cyclohexane, allyl-, Allyl-cyclohexan
| Molecular Formula | C9H16 |
|---|---|
| Molecular Weight | 124.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 124.1252 |
| Heavy Atoms | 9 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 2114-42-3 |
|---|---|
| SMILES | C=CCC1CCCCC1 |
| InChIKey | KVOZXXSUSRZIKD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allylcyclohexane (CAS 2114-42-3), with molecular formula C9H16 and molecular weight 124.13 g/mol. IUPAC: prop-2-enylcyclohexane.
Chemical Property Profile of Allylcyclohexane
Property Insights of Allylcyclohexane
The XLogP value of 4.1 indicates that Allylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Allylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allylcyclohexane 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 Allylcyclohexane?
The CAS number of Allylcyclohexane is 2114-42-3.
What is the molecular formula of Allylcyclohexane?
The molecular formula of Allylcyclohexane is C9H16.
What is the molecular weight of Allylcyclohexane?
The molecular weight of Allylcyclohexane is 124.13 g/mol.
Where can I buy Allylcyclohexane?
You can request a quote for Allylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for Allylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.