Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate
TL;DR: Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate (CAS 5059-56-3) is a chemical compound with molecular formula C19H22O2 and molecular weight 282.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate
Also Known As: BOHLMANN K3505, heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate, Heptadeca-2,8,10,16-tetraene-4,6-diyn-1-yl acetate, all-trans-Heptadeca-2,8,10,16-tetraen-4,6-diin-1-ol-acetat
| Molecular Formula | C19H22O2 |
|---|---|
| Molecular Weight | 282.16 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 282.162 |
| Heavy Atoms | 21 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 5059-56-3 |
|---|---|
| SMILES | CC(=O)OCC=CC#CC#CC=CC=CCCCCC=C |
| InChIKey | SSVVJPYTBYRAMR-UHFFFAOYSA-N |
Product Overview
Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate (CAS 5059-56-3), with molecular formula C19H22O2 and molecular weight 282.16 g/mol. IUPAC: heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate.
Chemical Property Profile of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate
Property Insights of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate
The XLogP value of 5.2 indicates that Heptadeca-2,8,10,16-tetraen-4,6-diynyl 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, Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate?
The CAS number of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate is 5059-56-3.
What is the molecular formula of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate?
The molecular formula of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate is C19H22O2.
What is the molecular weight of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate?
The molecular weight of Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate is 282.16 g/mol.
Where can I buy Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate?
You can request a quote for Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate?
Yes, KEHONG BIO provides custom synthesis services for Heptadeca-2,8,10,16-tetraen-4,6-diynyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.