Allyl cyclohexanevalerate
TL;DR: Allyl cyclohexanevalerate (CAS 7493-68-7) is a chemical compound with molecular formula C14H24O2 and molecular weight 224.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 5-cyclohexylpentanoate
Also Known As: Allyl cyclohexanevalerate, allylcyclohexanevalerate, Allyl 5-cyclohexylpentanoate, Allyl cyclohexylvalerate, 2-Propenyl cyclohexanepentanoate
| Molecular Formula | C14H24O2 |
|---|---|
| Molecular Weight | 224.18 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 224.17763 |
| Heavy Atoms | 16 |
| Complexity | 205.0 |
| Boiling Point | 119.00 °C. @ 1.00 mm Hg |
| Density | 0.942-0.947 |
| Solubility | Insoluble in water, soluble in ethanol, essential oils and flavour materials, and poorly soluble in propylene glycol |
| Refractive Index | 1.4605 (22°) |
Chemical Identifiers
| CAS Number | 7493-68-7 |
|---|---|
| SMILES | C=CCOC(=O)CCCCC1CCCCC1 |
| InChIKey | NDXGAVFJHHVIQN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allyl cyclohexanevalerate (CAS 7493-68-7), with molecular formula C14H24O2 and molecular weight 224.18 g/mol. IUPAC: prop-2-enyl 5-cyclohexylpentanoate.
Chemical Property Profile of Allyl cyclohexanevalerate
Property Insights of Allyl cyclohexanevalerate
The XLogP value of 4.9 indicates that Allyl cyclohexanevalerate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Allyl cyclohexanevalerate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allyl cyclohexanevalerate has 0 hydrogen bond donor(s) and 2 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 Allyl cyclohexanevalerate?
The CAS number of Allyl cyclohexanevalerate is 7493-68-7.
What is the molecular formula of Allyl cyclohexanevalerate?
The molecular formula of Allyl cyclohexanevalerate is C14H24O2.
What is the molecular weight of Allyl cyclohexanevalerate?
The molecular weight of Allyl cyclohexanevalerate is 224.18 g/mol.
Where can I buy Allyl cyclohexanevalerate?
You can request a quote for Allyl cyclohexanevalerate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl cyclohexanevalerate?
Yes, KEHONG BIO provides custom synthesis services for Allyl cyclohexanevalerate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.