N-(2-bromophenyl)-2-cyanoacetamide
TL;DR: N-(2-bromophenyl)-2-cyanoacetamide (CAS 80277-87-8) is a chemical compound with molecular formula C9H7BrN2O and molecular weight 237.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromophenyl)-2-cyanoacetamide
Also Known As: N-(2-bromophenyl)-2-cyanoacetamide, 2'-bromo-2-cyanoacetanilide, N-(2-bromophenyl)-2-cyano-acetamide, 2-cyano-N-[2-(bromo)phenyl]acetamide, Acetamide, N-(2-bromophenyl)-2-cyano-
| Molecular Formula | C9H7BrN2O |
|---|---|
| Molecular Weight | 237.97 g/mol |
| LogP | 2.30128 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.97418 |
| Heavy Atoms | 13 |
| Complexity | 356.8775 |
Chemical Identifiers
| CAS Number | 80277-87-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)CC#N)Br |
Product Overview
N-(2-bromophenyl)-2-cyanoacetamide (CAS 80277-87-8), with molecular formula C9H7BrN2O and molecular weight 237.97 g/mol. IUPAC: N-(2-bromophenyl)-2-cyanoacetamide.
Chemical Property Profile of N-(2-bromophenyl)-2-cyanoacetamide
Property Insights of N-(2-bromophenyl)-2-cyanoacetamide
The XLogP value of 2.30128 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-bromophenyl)-2-cyanoacetamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(2-bromophenyl)-2-cyanoacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-bromophenyl)-2-cyanoacetamide 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-(2-bromophenyl)-2-cyanoacetamide?
The CAS number of N-(2-bromophenyl)-2-cyanoacetamide is 80277-87-8.
What is the molecular formula of N-(2-bromophenyl)-2-cyanoacetamide?
The molecular formula of N-(2-bromophenyl)-2-cyanoacetamide is C9H7BrN2O.
What is the molecular weight of N-(2-bromophenyl)-2-cyanoacetamide?
The molecular weight of N-(2-bromophenyl)-2-cyanoacetamide is 237.97 g/mol.
Where can I buy N-(2-bromophenyl)-2-cyanoacetamide?
You can request a quote for N-(2-bromophenyl)-2-cyanoacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-bromophenyl)-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-bromophenyl)-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.