(3E,5E,10E)-hexadeca-3,5,10-trienenitrile
TL;DR: (3E,5E,10E)-hexadeca-3,5,10-trienenitrile (CAS 68513-04-2) is a chemical compound with molecular formula C16H25N and molecular weight 231.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E,5E,10E)-hexadeca-3,5,10-trienenitrile
Also Known As: EINECS 270-994-0, Nitriles, C14-18 and C16-18-unsatd., Nitriles, C14-18 and C16-18-unsatd, (C14-C18) and (C16-C18)Unsaturated alkyl nitrile, (C14-C18), and (C16-C18) Unsaturated alkylnitrile
| Molecular Formula | C16H25N |
|---|---|
| Molecular Weight | 231.20 g/mol |
| LogP | 5.31928 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 231.1987 |
| Heavy Atoms | 17 |
| Complexity | 265.74 |
Chemical Identifiers
| CAS Number | 68513-04-2 |
|---|---|
| SMILES | CCCCC/C=C/CCC/C=C/C=C/CC#N |
Product Overview
(3E,5E,10E)-hexadeca-3,5,10-trienenitrile (CAS 68513-04-2), with molecular formula C16H25N and molecular weight 231.20 g/mol. IUPAC: (3E,5E,10E)-hexadeca-3,5,10-trienenitrile.
Chemical Property Profile of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile
Property Insights of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile
The XLogP value of 5.31928 indicates that (3E,5E,10E)-hexadeca-3,5,10-trienenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, (3E,5E,10E)-hexadeca-3,5,10-trienenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E,5E,10E)-hexadeca-3,5,10-trienenitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile?
The CAS number of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile is 68513-04-2.
What is the molecular formula of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile?
The molecular formula of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile is C16H25N.
What is the molecular weight of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile?
The molecular weight of (3E,5E,10E)-hexadeca-3,5,10-trienenitrile is 231.20 g/mol.
Where can I buy (3E,5E,10E)-hexadeca-3,5,10-trienenitrile?
You can request a quote for (3E,5E,10E)-hexadeca-3,5,10-trienenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E,5E,10E)-hexadeca-3,5,10-trienenitrile?
Yes, KEHONG BIO provides custom synthesis services for (3E,5E,10E)-hexadeca-3,5,10-trienenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.