N-Formyl-3-oxobutanamide
TL;DR: N-Formyl-3-oxobutanamide (CAS 82437-52-3) is a chemical compound with molecular formula C5H7NO3 and molecular weight 129.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-formyl-3-oxobutanamide
Also Known As: N-Formyl-3-oxobutanamide, N-formylacetoacetamide, N-formyl-3-oxo-butanamide, Butanamide, N-formyl-3-oxo- (9CI), NCI60_010607
| Molecular Formula | C5H7NO3 |
|---|---|
| Molecular Weight | 129.04 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 129.04259 |
| Heavy Atoms | 9 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 82437-52-3 |
|---|---|
| SMILES | CC(=O)CC(=O)NC=O |
| InChIKey | AZKOSEJTNMVHTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Formyl-3-oxobutanamide (CAS 82437-52-3), with molecular formula C5H7NO3 and molecular weight 129.04 g/mol. IUPAC: N-formyl-3-oxobutanamide.
Chemical Property Profile of N-Formyl-3-oxobutanamide
Property Insights of N-Formyl-3-oxobutanamide
The XLogP value of -0.8 indicates that N-Formyl-3-oxobutanamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Formyl-3-oxobutanamide. Following Lipinski's Rule of Five, N-Formyl-3-oxobutanamide 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-Formyl-3-oxobutanamide?
The CAS number of N-Formyl-3-oxobutanamide is 82437-52-3.
What is the molecular formula of N-Formyl-3-oxobutanamide?
The molecular formula of N-Formyl-3-oxobutanamide is C5H7NO3.
What is the molecular weight of N-Formyl-3-oxobutanamide?
The molecular weight of N-Formyl-3-oxobutanamide is 129.04 g/mol.
Where can I buy N-Formyl-3-oxobutanamide?
You can request a quote for N-Formyl-3-oxobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Formyl-3-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-Formyl-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.