Dec-7-enyl acetate
TL;DR: Dec-7-enyl acetate (CAS 13856-97-8) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dec-7-enyl acetate
Also Known As: dec-7-enyl acetate, (E)-7-Decenyl acetate, Z-7-decenyl acetate, 7Z-decen-1-acetate, dec-7-en-1-yl acetate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 13856-97-8 |
|---|---|
| SMILES | CCC=CCCCCCCOC(=O)C |
| InChIKey | DEOHUYGDZACDBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dec-7-enyl acetate (CAS 13856-97-8), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: dec-7-enyl acetate.
Chemical Property Profile of Dec-7-enyl acetate
Property Insights of Dec-7-enyl acetate
The XLogP value of 3.7 indicates that Dec-7-enyl 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, Dec-7-enyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dec-7-enyl 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 Dec-7-enyl acetate?
The CAS number of Dec-7-enyl acetate is 13856-97-8.
What is the molecular formula of Dec-7-enyl acetate?
The molecular formula of Dec-7-enyl acetate is C12H22O2.
What is the molecular weight of Dec-7-enyl acetate?
The molecular weight of Dec-7-enyl acetate is 198.16 g/mol.
Where can I buy Dec-7-enyl acetate?
You can request a quote for Dec-7-enyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dec-7-enyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Dec-7-enyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.