3-(Docosylamino)propiononitrile
TL;DR: 3-(Docosylamino)propiononitrile (CAS 94109-54-3) is a chemical compound with molecular formula C25H50N2 and molecular weight 378.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(docosylamino)propanenitrile
Also Known As: 3-(Docosylamino)propiononitrile, 3-(docosylamino)propanenitrile, EINECS 302-496-7
| Molecular Formula | C25H50N2 |
|---|---|
| Molecular Weight | 378.40 g/mol |
| LogP | 8.31158 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Exact Mass | 378.3974 |
| Heavy Atoms | 27 |
| Complexity | 295.1892 |
Chemical Identifiers
| CAS Number | 94109-54-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCCNCCC#N |
Product Overview
3-(Docosylamino)propiononitrile (CAS 94109-54-3), with molecular formula C25H50N2 and molecular weight 378.40 g/mol. IUPAC: 3-(docosylamino)propanenitrile.
Chemical Property Profile of 3-(Docosylamino)propiononitrile
Property Insights of 3-(Docosylamino)propiononitrile
The XLogP value of 8.31158 indicates that 3-(Docosylamino)propiononitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.82 Ų, 3-(Docosylamino)propiononitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Docosylamino)propiononitrile has 1 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 3-(Docosylamino)propiononitrile?
The CAS number of 3-(Docosylamino)propiononitrile is 94109-54-3.
What is the molecular formula of 3-(Docosylamino)propiononitrile?
The molecular formula of 3-(Docosylamino)propiononitrile is C25H50N2.
What is the molecular weight of 3-(Docosylamino)propiononitrile?
The molecular weight of 3-(Docosylamino)propiononitrile is 378.40 g/mol.
Where can I buy 3-(Docosylamino)propiononitrile?
You can request a quote for 3-(Docosylamino)propiononitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Docosylamino)propiononitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Docosylamino)propiononitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.