2-(2-Cyanophenyl)oxazole
TL;DR: 2-(2-Cyanophenyl)oxazole (CAS 959063-06-0) is a chemical compound with molecular formula C10H6N2O and molecular weight 170.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-oxazol-2-yl)benzonitrile
Also Known As: 2-(2-Cyanophenyl)oxazole, 2-(2-Oxazolyl)benzonitrile, 2-(1,3-Oxazol-2-yl)benzonitrile, 2-(1,3-Oxazol-2-yl)benzonitrile #
| Molecular Formula | C10H6N2O |
|---|---|
| Molecular Weight | 170.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.04802 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 959063-06-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C#N)C2=NC=CO2 |
| InChIKey | RUIPXRULXWYXNR-UHFFFAOYSA-N |
Product Overview
2-(2-Cyanophenyl)oxazole (CAS 959063-06-0), with molecular formula C10H6N2O and molecular weight 170.05 g/mol. IUPAC: 2-(1,3-oxazol-2-yl)benzonitrile.
Chemical Property Profile of 2-(2-Cyanophenyl)oxazole
Property Insights of 2-(2-Cyanophenyl)oxazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Cyanophenyl)oxazole. With a topological polar surface area (TPSA) of 49.8 Ų, 2-(2-Cyanophenyl)oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Cyanophenyl)oxazole has 0 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 2-(2-Cyanophenyl)oxazole?
The CAS number of 2-(2-Cyanophenyl)oxazole is 959063-06-0.
What is the molecular formula of 2-(2-Cyanophenyl)oxazole?
The molecular formula of 2-(2-Cyanophenyl)oxazole is C10H6N2O.
What is the molecular weight of 2-(2-Cyanophenyl)oxazole?
The molecular weight of 2-(2-Cyanophenyl)oxazole is 170.05 g/mol.
Where can I buy 2-(2-Cyanophenyl)oxazole?
You can request a quote for 2-(2-Cyanophenyl)oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Cyanophenyl)oxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Cyanophenyl)oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.