Cedrenyl acetate
TL;DR: Cedrenyl acetate (CAS 1405-92-1) is a chemical compound with molecular formula C17H26O2 and molecular weight 262.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,5S,7R)-2,6,6-trimethyl-8-tricyclo[5.3.1.01,5]undec-8-enyl]methyl acetate
Also Known As: Cedrenyl acetate, Cedrenol, acetate, cedr-8-en-15-yl acetate, Cedrenol, acetate (8CI), [(1S,2R,5S,7R)-2,6,6-trimethyl-8-tricyclo[5.3.1.01,5]undec-8-enyl]methyl acetate
| Molecular Formula | C17H26O2 |
|---|---|
| Molecular Weight | 262.19 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.19327 |
| Heavy Atoms | 19 |
| Complexity | 435.0 |
Chemical Identifiers
| CAS Number | 1405-92-1 |
|---|---|
| SMILES | C[C@@H]1CC[C@@H]2[C@]13CC=C([C@H](C3)C2(C)C)COC(=O)C |
| InChIKey | AICQDCHSUWFHCC-ZUFFMMDNSA-N |
Product Overview
Cedrenyl acetate (CAS 1405-92-1), with molecular formula C17H26O2 and molecular weight 262.19 g/mol. IUPAC: [(1S,2R,5S,7R)-2,6,6-trimethyl-8-tricyclo[5.3.1.01,5]undec-8-enyl]methyl acetate.
Chemical Property Profile of Cedrenyl acetate
Property Insights of Cedrenyl acetate
The XLogP value of 3.9 indicates that Cedrenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cedrenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cedrenyl 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 Cedrenyl acetate?
The CAS number of Cedrenyl acetate is 1405-92-1.
What is the molecular formula of Cedrenyl acetate?
The molecular formula of Cedrenyl acetate is C17H26O2.
What is the molecular weight of Cedrenyl acetate?
The molecular weight of Cedrenyl acetate is 262.19 g/mol.
Where can I buy Cedrenyl acetate?
You can request a quote for Cedrenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cedrenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Cedrenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.