Ethyl cyclohexylideneacetate
TL;DR: Ethyl cyclohexylideneacetate (CAS 1552-92-7) 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.
ethyl 2-cyclohexylideneacetate
Also Known As: ethyl 2-cyclohexylideneacetate, Ethyl cyclohexylideneacetate, ethyl 2-cyclohexylidenacetate, Cyclohexylideneacetic Acid Ethyl Ester, ethylcyclohexylidenacetate
| 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 | 174.0 |
Chemical Identifiers
| CAS Number | 1552-92-7 |
|---|---|
| SMILES | CCOC(=O)C=C1CCCCC1 |
| InChIKey | MCWDXHYYYNGYGK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl cyclohexylideneacetate (CAS 1552-92-7), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: ethyl 2-cyclohexylideneacetate.
Chemical Property Profile of Ethyl cyclohexylideneacetate
Property Insights of Ethyl cyclohexylideneacetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl cyclohexylideneacetate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl cyclohexylideneacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl cyclohexylideneacetate 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 Ethyl cyclohexylideneacetate?
The CAS number of Ethyl cyclohexylideneacetate is 1552-92-7.
What is the molecular formula of Ethyl cyclohexylideneacetate?
The molecular formula of Ethyl cyclohexylideneacetate is C10H16O2.
What is the molecular weight of Ethyl cyclohexylideneacetate?
The molecular weight of Ethyl cyclohexylideneacetate is 168.12 g/mol.
Where can I buy Ethyl cyclohexylideneacetate?
You can request a quote for Ethyl cyclohexylideneacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cyclohexylideneacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cyclohexylideneacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.