Tetradec-12-en-9-ynyl acetate
TL;DR: Tetradec-12-en-9-ynyl acetate (CAS 71394-01-9) is a chemical compound with molecular formula C16H26O2 and molecular weight 250.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetradec-12-en-9-ynyl acetate
Also Known As: 12-Tetradecen-9-yn-1-ol, acetate, (12E)-
| Molecular Formula | C16H26O2 |
|---|---|
| Molecular Weight | 250.19 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 250.19328 |
| Heavy Atoms | 18 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 71394-01-9 |
|---|---|
| SMILES | CC=CCC#CCCCCCCCCOC(=O)C |
| InChIKey | XEGTWQITZCHUAR-UHFFFAOYSA-N |
Product Overview
Tetradec-12-en-9-ynyl acetate (CAS 71394-01-9), with molecular formula C16H26O2 and molecular weight 250.19 g/mol. IUPAC: tetradec-12-en-9-ynyl acetate.
Chemical Property Profile of Tetradec-12-en-9-ynyl acetate
Property Insights of Tetradec-12-en-9-ynyl acetate
The XLogP value of 5.0 indicates that Tetradec-12-en-9-ynyl 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, Tetradec-12-en-9-ynyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetradec-12-en-9-ynyl 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 Tetradec-12-en-9-ynyl acetate?
The CAS number of Tetradec-12-en-9-ynyl acetate is 71394-01-9.
What is the molecular formula of Tetradec-12-en-9-ynyl acetate?
The molecular formula of Tetradec-12-en-9-ynyl acetate is C16H26O2.
What is the molecular weight of Tetradec-12-en-9-ynyl acetate?
The molecular weight of Tetradec-12-en-9-ynyl acetate is 250.19 g/mol.
Where can I buy Tetradec-12-en-9-ynyl acetate?
You can request a quote for Tetradec-12-en-9-ynyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetradec-12-en-9-ynyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Tetradec-12-en-9-ynyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.