alpha-Cembrenediol
TL;DR: alpha-Cembrenediol (CAS 57605-80-8) is a chemical compound with molecular formula C20H34O2 and molecular weight 306.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-4,8,13-triene-1,3-diol
Also Known As: beta-Cembrenediol, b-Cembrenediol, ?-Cembrenediol, alpha-Cembrenediol, .beta.-Cembrenediol
| Molecular Formula | C20H34O2 |
|---|---|
| Molecular Weight | 306.26 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 306.2559 |
| Heavy Atoms | 22 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 57605-80-8 |
|---|---|
| SMILES | CC1=CCCC(=CC(CC(C=CC(CC1)C(C)C)(C)O)O)C |
| InChIKey | RIVKDDXPCFBMOV-UHFFFAOYSA-N |
Product Overview
alpha-Cembrenediol (CAS 57605-80-8), with molecular formula C20H34O2 and molecular weight 306.26 g/mol. IUPAC: 1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-4,8,13-triene-1,3-diol.
Chemical Property Profile of alpha-Cembrenediol
Property Insights of alpha-Cembrenediol
The XLogP value of 4.0 indicates that alpha-Cembrenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, alpha-Cembrenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Cembrenediol has 2 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-Cembrenediol?
The CAS number of alpha-Cembrenediol is 57605-80-8.
What is the molecular formula of alpha-Cembrenediol?
The molecular formula of alpha-Cembrenediol is C20H34O2.
What is the molecular weight of alpha-Cembrenediol?
The molecular weight of alpha-Cembrenediol is 306.26 g/mol.
Where can I buy alpha-Cembrenediol?
You can request a quote for alpha-Cembrenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Cembrenediol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Cembrenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.