![2'-Chloro-[1,1'-biphenyl]-3-carbonitrile structure](/static/products/893/893734-75-3.png)
2'-Chloro-[1,1'-biphenyl]-3-carbonitrile
TL;DR: 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile (CAS 893734-75-3) is a chemical compound with molecular formula C13H8ClN and molecular weight 213.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)benzonitrile
Also Known As: 3-(2-chlorophenyl)benzonitrile, 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile, 2'-chloro[1,1'-biphenyl]-3-carbonitrile, BB 0223022, A1-75227
| Molecular Formula | C13H8ClN |
|---|---|
| Molecular Weight | 213.03 g/mol |
| LogP | 3.87868 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.03453 |
| Heavy Atoms | 15 |
| Complexity | 526.0543 |
Chemical Identifiers
| CAS Number | 893734-75-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=CC=CC(=C2)C#N)Cl |
Product Overview
2'-Chloro-[1,1'-biphenyl]-3-carbonitrile (CAS 893734-75-3), with molecular formula C13H8ClN and molecular weight 213.03 g/mol. IUPAC: 3-(2-chlorophenyl)benzonitrile.
Chemical Property Profile of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile
Property Insights of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile
The XLogP value of 3.87868 indicates that 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.79 Ų, 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile 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'-Chloro-[1,1'-biphenyl]-3-carbonitrile?
The CAS number of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile is 893734-75-3.
What is the molecular formula of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile?
The molecular formula of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile is C13H8ClN.
What is the molecular weight of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile?
The molecular weight of 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile is 213.03 g/mol.
Where can I buy 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile?
You can request a quote for 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2'-Chloro-[1,1'-biphenyl]-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.