4-(2-Aminophenoxy)benzonitrile
TL;DR: 4-(2-Aminophenoxy)benzonitrile (CAS 30202-92-7) is a chemical compound with molecular formula C13H10N2O and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-aminophenoxy)benzonitrile
Also Known As: 4-(2-aminophenoxy)benzonitrile, Sodium choleate, 2-(4-cyanophenoxy)aniline, 4-(2-Amino-phenoxy)-benzonitrile, 4-(2-aminophenoxy)benzenecarbonitrile
| Molecular Formula | C13H10N2O |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 2.93278 |
| Topological Polar Surface Area | 59.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.07932 |
| Heavy Atoms | 16 |
| Complexity | 526.374 |
Chemical Identifiers
| CAS Number | 30202-92-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)OC2=CC=C(C=C2)C#N |
Product Overview
4-(2-Aminophenoxy)benzonitrile (CAS 30202-92-7), with molecular formula C13H10N2O and molecular weight 210.08 g/mol. IUPAC: 4-(2-aminophenoxy)benzonitrile.
Chemical Property Profile of 4-(2-Aminophenoxy)benzonitrile
Property Insights of 4-(2-Aminophenoxy)benzonitrile
The XLogP value of 2.93278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Aminophenoxy)benzonitrile. With a topological polar surface area (TPSA) of 59.04 Ų, 4-(2-Aminophenoxy)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Aminophenoxy)benzonitrile has 1 hydrogen bond donor(s) and 3 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-(2-Aminophenoxy)benzonitrile?
The CAS number of 4-(2-Aminophenoxy)benzonitrile is 30202-92-7.
What is the molecular formula of 4-(2-Aminophenoxy)benzonitrile?
The molecular formula of 4-(2-Aminophenoxy)benzonitrile is C13H10N2O.
What is the molecular weight of 4-(2-Aminophenoxy)benzonitrile?
The molecular weight of 4-(2-Aminophenoxy)benzonitrile is 210.08 g/mol.
Where can I buy 4-(2-Aminophenoxy)benzonitrile?
You can request a quote for 4-(2-Aminophenoxy)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Aminophenoxy)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Aminophenoxy)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.