环己基丙酸烯丙酯
TL;DR: 环己基丙酸烯丙酯 (CAS 2705-87-5) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环己基丙酸烯丙酯
prop-2-enyl 3-cyclohexylpropanoate
Also Known As: Allyl 3-cyclohexylpropanoate, Allyl cyclohexanepropionate, Allyl cyclohexylpropionate, Ananolide, Allyl 3-cyclohexylpropionate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 181.0 |
| Boiling Point | 91.00 °C. @ 1.00 mm Hg |
| Density | 0.945-0.950 |
| Solubility | Soluble in ether, higher oils and fatty oils. Insoluble in glycerine and water |
| Refractive Index | 1.457-1.462 |
Chemical Identifiers
| CAS Number | 2705-87-5 |
|---|---|
| SMILES | C=CCOC(=O)CCC1CCCCC1 |
| InChIKey | TWXUTZNBHUWMKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
环己基丙酸烯丙酯 (CAS 2705-87-5), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: prop-2-enyl 3-cyclohexylpropanoate.
Chemical Property Profile of 环己基丙酸烯丙酯
Property Insights of 环己基丙酸烯丙酯
The XLogP value of 3.8 indicates that 环己基丙酸烯丙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 环己基丙酸烯丙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环己基丙酸烯丙酯 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 环己基丙酸烯丙酯?
The CAS number of 环己基丙酸烯丙酯 is 2705-87-5.
What is the molecular formula of 环己基丙酸烯丙酯?
The molecular formula of 环己基丙酸烯丙酯 is C12H20O2.
What is the molecular weight of 环己基丙酸烯丙酯?
The molecular weight of 环己基丙酸烯丙酯 is 196.15 g/mol.
Where can I buy 环己基丙酸烯丙酯?
You can request a quote for 环己基丙酸烯丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环己基丙酸烯丙酯?
Yes, KEHONG BIO provides custom synthesis services for 环己基丙酸烯丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.