alpha-Campholene acetate
TL;DR: alpha-Campholene acetate (CAS 1727-68-0) 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.
2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethyl acetate
Also Known As: alpha-Campholene acetate, CAMPHOLENE ACETATE, .alpha.-Campholenyl acetate, alpha-Campholenyl acetate, Campholenic alcohol acetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 1727-68-0 |
|---|---|
| SMILES | CC1=CCC(C1(C)C)CCOC(=O)C |
| InChIKey | HBRWKAJTMKFEQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Campholene acetate (CAS 1727-68-0), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 2-(2,2,3-trimethylcyclopent-3-en-1-yl)ethyl acetate.
Chemical Property Profile of alpha-Campholene acetate
Property Insights of alpha-Campholene acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Campholene acetate. With a topological polar surface area (TPSA) of 26.3 Ų, alpha-Campholene acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Campholene 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 alpha-Campholene acetate?
The CAS number of alpha-Campholene acetate is 1727-68-0.
What is the molecular formula of alpha-Campholene acetate?
The molecular formula of alpha-Campholene acetate is C12H20O2.
What is the molecular weight of alpha-Campholene acetate?
The molecular weight of alpha-Campholene acetate is 196.15 g/mol.
Where can I buy alpha-Campholene acetate?
You can request a quote for alpha-Campholene acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Campholene acetate?
Yes, KEHONG BIO provides custom synthesis services for alpha-Campholene acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.