N-(3-chlorophenyl)-1-cyanoformamide
TL;DR: N-(3-chlorophenyl)-1-cyanoformamide (CAS 15313-46-9) is a chemical compound with molecular formula C8H5ClN2O and molecular weight 180.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-1-cyanoformamide
Also Known As: N-(3-chlorophenyl)-1-cyanoformamide, 3-Chlor-oxanilsaeurenitril, m-Chloro-1-cyanoformanilide, (3-chlorophenyl)carbamoyl cyanide, 1-Chloro-3-[(cyanocarbonyl)amino]benzene
| Molecular Formula | C8H5ClN2O |
|---|---|
| Molecular Weight | 180.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.00903 |
| Heavy Atoms | 12 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 15313-46-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC(=O)C#N |
| InChIKey | JWDYTQCFUCWWOY-UHFFFAOYSA-N |
Product Overview
N-(3-chlorophenyl)-1-cyanoformamide (CAS 15313-46-9), with molecular formula C8H5ClN2O and molecular weight 180.01 g/mol. IUPAC: N-(3-chlorophenyl)-1-cyanoformamide.
Chemical Property Profile of N-(3-chlorophenyl)-1-cyanoformamide
Property Insights of N-(3-chlorophenyl)-1-cyanoformamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-1-cyanoformamide. With a topological polar surface area (TPSA) of 52.9 Ų, N-(3-chlorophenyl)-1-cyanoformamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-1-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-(3-chlorophenyl)-1-cyanoformamide?
The CAS number of N-(3-chlorophenyl)-1-cyanoformamide is 15313-46-9.
What is the molecular formula of N-(3-chlorophenyl)-1-cyanoformamide?
The molecular formula of N-(3-chlorophenyl)-1-cyanoformamide is C8H5ClN2O.
What is the molecular weight of N-(3-chlorophenyl)-1-cyanoformamide?
The molecular weight of N-(3-chlorophenyl)-1-cyanoformamide is 180.01 g/mol.
Where can I buy N-(3-chlorophenyl)-1-cyanoformamide?
You can request a quote for N-(3-chlorophenyl)-1-cyanoformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-1-cyanoformamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-1-cyanoformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.