N-Acetyl-2-cyanoacetamide
TL;DR: N-Acetyl-2-cyanoacetamide (CAS 35812-35-2) is a chemical compound with molecular formula C5H6N2O2 and molecular weight 126.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-acetyl-2-cyanoacetamide
Also Known As: n-acetyl-2-cyanoacetamide, N1-acetyl-2-cyanoacetamide, N-(2-cyanoacetyl)acetamide, Acetamide, N-acetyl-2-cyano-, RefChem:363061
| Molecular Formula | C5H6N2O2 |
|---|---|
| Molecular Weight | 126.04 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.04293 |
| Heavy Atoms | 9 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 35812-35-2 |
|---|---|
| SMILES | CC(=O)NC(=O)CC#N |
| InChIKey | KRLSYGUEXUKMQT-UHFFFAOYSA-N |
Product Overview
N-Acetyl-2-cyanoacetamide (CAS 35812-35-2), with molecular formula C5H6N2O2 and molecular weight 126.04 g/mol. IUPAC: N-acetyl-2-cyanoacetamide.
Chemical Property Profile of N-Acetyl-2-cyanoacetamide
Property Insights of N-Acetyl-2-cyanoacetamide
The XLogP value of -0.8 indicates that N-Acetyl-2-cyanoacetamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetyl-2-cyanoacetamide. Following Lipinski's Rule of Five, N-Acetyl-2-cyanoacetamide 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 N-Acetyl-2-cyanoacetamide?
The CAS number of N-Acetyl-2-cyanoacetamide is 35812-35-2.
What is the molecular formula of N-Acetyl-2-cyanoacetamide?
The molecular formula of N-Acetyl-2-cyanoacetamide is C5H6N2O2.
What is the molecular weight of N-Acetyl-2-cyanoacetamide?
The molecular weight of N-Acetyl-2-cyanoacetamide is 126.04 g/mol.
Where can I buy N-Acetyl-2-cyanoacetamide?
You can request a quote for N-Acetyl-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-Acetyl-2-cyanoacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-2-cyanoacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.