N-(O-Tolyl)cyanoformamide
TL;DR: N-(O-Tolyl)cyanoformamide (CAS 108994-75-8) is a chemical compound with molecular formula C9H8N2O and molecular weight 160.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-N-(2-methylphenyl)formamide
Also Known As: N-(o-Tolyl)cyanoformamide, 1-cyano-N-(2-methylphenyl)formamide, N-(2-methylphenyl)carbamoyl cyanide, J2.026.717H, 659-142-2
| Molecular Formula | C9H8N2O |
|---|---|
| Molecular Weight | 160.06 g/mol |
| LogP | 1.4571 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.06366 |
| Heavy Atoms | 12 |
| Complexity | 338.62692 |
Chemical Identifiers
| CAS Number | 108994-75-8 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C#N |
Product Overview
N-(O-Tolyl)cyanoformamide (CAS 108994-75-8), with molecular formula C9H8N2O and molecular weight 160.06 g/mol. IUPAC: 1-cyano-N-(2-methylphenyl)formamide.
Chemical Property Profile of N-(O-Tolyl)cyanoformamide
Property Insights of N-(O-Tolyl)cyanoformamide
The XLogP value of 1.4571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(O-Tolyl)cyanoformamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(O-Tolyl)cyanoformamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(O-Tolyl)cyanoformamide 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 N-(O-Tolyl)cyanoformamide?
The CAS number of N-(O-Tolyl)cyanoformamide is 108994-75-8.
What is the molecular formula of N-(O-Tolyl)cyanoformamide?
The molecular formula of N-(O-Tolyl)cyanoformamide is C9H8N2O.
What is the molecular weight of N-(O-Tolyl)cyanoformamide?
The molecular weight of N-(O-Tolyl)cyanoformamide is 160.06 g/mol.
Where can I buy N-(O-Tolyl)cyanoformamide?
You can request a quote for N-(O-Tolyl)cyanoformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(O-Tolyl)cyanoformamide?
Yes, KEHONG BIO provides custom synthesis services for N-(O-Tolyl)cyanoformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.