(4-Ethylcyclohexyl) acetate
TL;DR: (4-Ethylcyclohexyl) acetate (CAS 500283-40-9) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethylcyclohexyl) acetate
Also Known As: 4-ethylcyclohexyl acetate, (4-ethylcyclohexyl) acetate, Acetic acid 4-ethylcyclohexyl ester, Cyclohexanol, 4-ethyl-, acetate (9CI)
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 500283-40-9 |
|---|---|
| SMILES | CCC1CCC(CC1)OC(=O)C |
| InChIKey | XJWLSIUGKJSAFZ-UHFFFAOYSA-N |
Product Overview
(4-Ethylcyclohexyl) acetate (CAS 500283-40-9), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: (4-ethylcyclohexyl) acetate.
Chemical Property Profile of (4-Ethylcyclohexyl) acetate
Property Insights of (4-Ethylcyclohexyl) acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Ethylcyclohexyl) acetate. With a topological polar surface area (TPSA) of 26.3 Ų, (4-Ethylcyclohexyl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Ethylcyclohexyl) 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 (4-Ethylcyclohexyl) acetate?
The CAS number of (4-Ethylcyclohexyl) acetate is 500283-40-9.
What is the molecular formula of (4-Ethylcyclohexyl) acetate?
The molecular formula of (4-Ethylcyclohexyl) acetate is C10H18O2.
What is the molecular weight of (4-Ethylcyclohexyl) acetate?
The molecular weight of (4-Ethylcyclohexyl) acetate is 170.13 g/mol.
Where can I buy (4-Ethylcyclohexyl) acetate?
You can request a quote for (4-Ethylcyclohexyl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Ethylcyclohexyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (4-Ethylcyclohexyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.