Propanenitrile, 3-(tridecyloxy)-
TL;DR: Propanenitrile, 3-(tridecyloxy)- (CAS 68239-19-0) is a chemical compound with molecular formula C16H31NO and molecular weight 253.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-tridecoxypropanenitrile
Also Known As: 3-Tridecoxypropanenitrile, 3- propiononitrile, 3-(Tridecyloxy)propiononitrile, 3-(tridecyloxy)propanenitrile, Propanenitrile, 3-(tridecyloxy)-
| Molecular Formula | C16H31NO |
|---|---|
| Molecular Weight | 253.24 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 253.24057 |
| Heavy Atoms | 18 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 68239-19-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCOCCC#N |
| InChIKey | QNXKSVYXNGTPLX-UHFFFAOYSA-N |
Product Overview
Propanenitrile, 3-(tridecyloxy)- (CAS 68239-19-0), with molecular formula C16H31NO and molecular weight 253.24 g/mol. IUPAC: 3-tridecoxypropanenitrile.
Chemical Property Profile of Propanenitrile, 3-(tridecyloxy)-
Property Insights of Propanenitrile, 3-(tridecyloxy)-
The XLogP value of 5.9 indicates that Propanenitrile, 3-(tridecyloxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.0 Ų, Propanenitrile, 3-(tridecyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 3-(tridecyloxy)- 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 Propanenitrile, 3-(tridecyloxy)-?
The CAS number of Propanenitrile, 3-(tridecyloxy)- is 68239-19-0.
What is the molecular formula of Propanenitrile, 3-(tridecyloxy)-?
The molecular formula of Propanenitrile, 3-(tridecyloxy)- is C16H31NO.
What is the molecular weight of Propanenitrile, 3-(tridecyloxy)-?
The molecular weight of Propanenitrile, 3-(tridecyloxy)- is 253.24 g/mol.
Where can I buy Propanenitrile, 3-(tridecyloxy)-?
You can request a quote for Propanenitrile, 3-(tridecyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-(tridecyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-(tridecyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.