N-(4-chloro-2-nitrophenyl)-3-oxobutanamide
TL;DR: N-(4-chloro-2-nitrophenyl)-3-oxobutanamide (CAS 34797-69-8) is a chemical compound with molecular formula C10H9ClN2O4 and molecular weight 256.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chloro-2-nitrophenyl)-3-oxobutanamide
Also Known As: N-(4-chloro-2-nitrophenyl)-3-oxobutanamide, N-(4-Chloro-2-nitro-phenyl)-3-oxo-butyramide, AAPCONA, N- -3-OXO-BUTYRAMIDE, N-acetoacetyl-4-chloro-2-nitroaniline
| Molecular Formula | C10H9ClN2O4 |
|---|---|
| Molecular Weight | 256.03 g/mol |
| LogP | 2.1658 |
| Topological Polar Surface Area | 89.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.0251 |
| Heavy Atoms | 17 |
| Complexity | 487.19427 |
Chemical Identifiers
| CAS Number | 34797-69-8 |
|---|---|
| SMILES | CC(=O)CC(=O)NC1=C(C=C(C=C1)Cl)[N+](=O)[O-] |
Product Overview
N-(4-chloro-2-nitrophenyl)-3-oxobutanamide (CAS 34797-69-8), with molecular formula C10H9ClN2O4 and molecular weight 256.03 g/mol. IUPAC: N-(4-chloro-2-nitrophenyl)-3-oxobutanamide.
Chemical Property Profile of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide
Property Insights of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide
The XLogP value of 2.1658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-chloro-2-nitrophenyl)-3-oxobutanamide. The TPSA of 89.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-chloro-2-nitrophenyl)-3-oxobutanamide. Following Lipinski's Rule of Five, N-(4-chloro-2-nitrophenyl)-3-oxobutanamide has 1 hydrogen bond donor(s) and 4 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-(4-chloro-2-nitrophenyl)-3-oxobutanamide?
The CAS number of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide is 34797-69-8.
What is the molecular formula of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide?
The molecular formula of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide is C10H9ClN2O4.
What is the molecular weight of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide?
The molecular weight of N-(4-chloro-2-nitrophenyl)-3-oxobutanamide is 256.03 g/mol.
Where can I buy N-(4-chloro-2-nitrophenyl)-3-oxobutanamide?
You can request a quote for N-(4-chloro-2-nitrophenyl)-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-(4-chloro-2-nitrophenyl)-3-oxobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-chloro-2-nitrophenyl)-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.