Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate
TL;DR: Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate (CAS 22406-80-0) is a chemical compound with molecular formula C10H16O3 and molecular weight 184.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate
Also Known As: 1-carbethoxymethyl-2-cyclohexen-1-ol, ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate, ethyl(1-hydroxycyclohex-2-en-1-yl)acetate, 2-Cyclohexene-1-acetic acid, 1-hydroxy-, ethyl ester, ethyl (1-hydroxycyclohex-2-en-1-yl)acetate
| Molecular Formula | C10H16O3 |
|---|---|
| Molecular Weight | 184.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.10994 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 22406-80-0 |
|---|---|
| SMILES | CCOC(=O)CC1(CCCC=C1)O |
| InChIKey | MZHSDNVNWQVFMZ-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate (CAS 22406-80-0), with molecular formula C10H16O3 and molecular weight 184.11 g/mol. IUPAC: ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate.
Chemical Property Profile of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate
Property Insights of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate. With a topological polar surface area (TPSA) of 46.5 Ų, Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate has 1 hydrogen bond donor(s) and 3 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 Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate?
The CAS number of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate is 22406-80-0.
What is the molecular formula of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate?
The molecular formula of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate is C10H16O3.
What is the molecular weight of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate?
The molecular weight of Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate is 184.11 g/mol.
Where can I buy Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate?
You can request a quote for Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(1-hydroxycyclohex-2-en-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.