3-(2-Phenylphenoxy)propanenitrile
TL;DR: 3-(2-Phenylphenoxy)propanenitrile (CAS 125849-31-2) is a chemical compound with molecular formula C15H13NO and molecular weight 223.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylphenoxy)propanenitrile
Also Known As: 3-(2-phenylphenoxy)propanenitrile, 3-(2-biphenylyloxy)propionitrile, Propanenitrile, 3-([1,1'-biphenyl]-2-yloxy)-, 3-([1,1'-biphenyl]-2-yloxy)propanenitrile, 3-[([1,1'-Biphenyl]-2-yl)oxy]propanenitrile
| Molecular Formula | C15H13NO |
|---|---|
| Molecular Weight | 223.10 g/mol |
| LogP | 3.64608 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.09972 |
| Heavy Atoms | 17 |
| Complexity | 513.94507 |
Chemical Identifiers
| CAS Number | 125849-31-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2OCCC#N |
Product Overview
3-(2-Phenylphenoxy)propanenitrile (CAS 125849-31-2), with molecular formula C15H13NO and molecular weight 223.10 g/mol. IUPAC: 3-(2-phenylphenoxy)propanenitrile.
Chemical Property Profile of 3-(2-Phenylphenoxy)propanenitrile
Property Insights of 3-(2-Phenylphenoxy)propanenitrile
The XLogP value of 3.64608 indicates that 3-(2-Phenylphenoxy)propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.02 Ų, 3-(2-Phenylphenoxy)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Phenylphenoxy)propanenitrile 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 3-(2-Phenylphenoxy)propanenitrile?
The CAS number of 3-(2-Phenylphenoxy)propanenitrile is 125849-31-2.
What is the molecular formula of 3-(2-Phenylphenoxy)propanenitrile?
The molecular formula of 3-(2-Phenylphenoxy)propanenitrile is C15H13NO.
What is the molecular weight of 3-(2-Phenylphenoxy)propanenitrile?
The molecular weight of 3-(2-Phenylphenoxy)propanenitrile is 223.10 g/mol.
Where can I buy 3-(2-Phenylphenoxy)propanenitrile?
You can request a quote for 3-(2-Phenylphenoxy)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Phenylphenoxy)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Phenylphenoxy)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.