4-(3-Hydroxyphenyl)benzonitrile
TL;DR: 4-(3-Hydroxyphenyl)benzonitrile (CAS 127703-35-9) is a chemical compound with molecular formula C13H9NO and molecular weight 195.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-hydroxyphenyl)benzonitrile
Also Known As: 4-(3-Hydroxyphenyl)benzonitrile, Ethyl 9-bromononanoate, 3'-Hydroxybiphenyl-4-carbonitrile, 3'-Hydroxy-[1,1'-biphenyl]-4-carbonitrile, 4'-Amino-3-Biphenylcarbonitrile
| Molecular Formula | C13H9NO |
|---|---|
| Molecular Weight | 195.07 g/mol |
| LogP | 2.93088 |
| Topological Polar Surface Area | 44.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 195.06842 |
| Heavy Atoms | 15 |
| Complexity | 508.80432 |
Chemical Identifiers
| CAS Number | 127703-35-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)C2=CC=C(C=C2)C#N |
Product Overview
4-(3-Hydroxyphenyl)benzonitrile (CAS 127703-35-9), with molecular formula C13H9NO and molecular weight 195.07 g/mol. IUPAC: 4-(3-hydroxyphenyl)benzonitrile.
Chemical Property Profile of 4-(3-Hydroxyphenyl)benzonitrile
Property Insights of 4-(3-Hydroxyphenyl)benzonitrile
The XLogP value of 2.93088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Hydroxyphenyl)benzonitrile. With a topological polar surface area (TPSA) of 44.02 Ų, 4-(3-Hydroxyphenyl)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Hydroxyphenyl)benzonitrile has 1 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 4-(3-Hydroxyphenyl)benzonitrile?
The CAS number of 4-(3-Hydroxyphenyl)benzonitrile is 127703-35-9.
What is the molecular formula of 4-(3-Hydroxyphenyl)benzonitrile?
The molecular formula of 4-(3-Hydroxyphenyl)benzonitrile is C13H9NO.
What is the molecular weight of 4-(3-Hydroxyphenyl)benzonitrile?
The molecular weight of 4-(3-Hydroxyphenyl)benzonitrile is 195.07 g/mol.
Where can I buy 4-(3-Hydroxyphenyl)benzonitrile?
You can request a quote for 4-(3-Hydroxyphenyl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Hydroxyphenyl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Hydroxyphenyl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.