cis-3-Vinylcyclohexyl acetate
TL;DR: cis-3-Vinylcyclohexyl acetate (CAS 94386-63-7) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,3S)-3-ethenylcyclohexyl] acetate
Also Known As: cis-3-Vinylcyclohexyl acetate, 3-Ethenylcyclohexyl acetate, (1r,3s)-3-ethenylcyclohexyl acetate, EINECS 305-286-3, [(1R,3S)-3-ethenylcyclohexyl] acetate
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 94386-63-7 |
|---|---|
| SMILES | CC(=O)O[C@@H]1CCC[C@@H](C1)C=C |
| InChIKey | MFFQZYIDSYOHOP-VHSXEESVSA-N |
Product Overview
cis-3-Vinylcyclohexyl acetate (CAS 94386-63-7), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: [(1R,3S)-3-ethenylcyclohexyl] acetate.
Chemical Property Profile of cis-3-Vinylcyclohexyl acetate
Property Insights of cis-3-Vinylcyclohexyl acetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-3-Vinylcyclohexyl acetate. With a topological polar surface area (TPSA) of 26.3 Ų, cis-3-Vinylcyclohexyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-3-Vinylcyclohexyl acetate 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 cis-3-Vinylcyclohexyl acetate?
The CAS number of cis-3-Vinylcyclohexyl acetate is 94386-63-7.
What is the molecular formula of cis-3-Vinylcyclohexyl acetate?
The molecular formula of cis-3-Vinylcyclohexyl acetate is C10H16O2.
What is the molecular weight of cis-3-Vinylcyclohexyl acetate?
The molecular weight of cis-3-Vinylcyclohexyl acetate is 168.12 g/mol.
Where can I buy cis-3-Vinylcyclohexyl acetate?
You can request a quote for cis-3-Vinylcyclohexyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-3-Vinylcyclohexyl acetate?
Yes, KEHONG BIO provides custom synthesis services for cis-3-Vinylcyclohexyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.