2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile
TL;DR: 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile (CAS 95065-61-5) is a chemical compound with molecular formula C15H10ClN and molecular weight 239.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-chlorophenyl)-3-phenylprop-2-enenitrile
Also Known As: Maybridge3_004848, ALPHA-(3-CHLOROPHENYL)CINNAMONITRILE, 2-(3-chlorophenyl)-3-phenylprop-2-enenitrile
| Molecular Formula | C15H10ClN |
|---|---|
| Molecular Weight | 239.05 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.05017 |
| Heavy Atoms | 17 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 95065-61-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=C(C#N)C2=CC(=CC=C2)Cl |
| InChIKey | OHZIRCUCNGKSMO-UHFFFAOYSA-N |
Product Overview
2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile (CAS 95065-61-5), with molecular formula C15H10ClN and molecular weight 239.05 g/mol. IUPAC: 2-(3-chlorophenyl)-3-phenylprop-2-enenitrile.
Chemical Property Profile of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile
Property Insights of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile
The XLogP value of 4.3 indicates that 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile has 0 hydrogen bond donor(s) and 1 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 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile?
The CAS number of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile is 95065-61-5.
What is the molecular formula of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile?
The molecular formula of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile is C15H10ClN.
What is the molecular weight of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile?
The molecular weight of 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile is 239.05 g/mol.
Where can I buy 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile?
You can request a quote for 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Chlorophenyl)-3-phenylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.