N-(2-Chloroethyl)-3-oxobutyramide
TL;DR: N-(2-Chloroethyl)-3-oxobutyramide (CAS 26244-71-3) is a chemical compound with molecular formula C6H10ClNO2 and molecular weight 163.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)-3-oxobutanamide
Also Known As: N-(2-Chloroethyl)-3-oxobutyramide, N-(2-chloroethyl)-3-oxobutanamide, EINECS 247-533-7, Butanamide,N-(2-chloroethyl)-3-oxo-, N-(2-chloro-ethyl)-3-oxo-butyramide
| Molecular Formula | C6H10ClNO2 |
|---|---|
| Molecular Weight | 163.04 g/mol |
| LogP | 0.3205 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.04001 |
| Heavy Atoms | 10 |
| Complexity | 135.7095 |
Chemical Identifiers
| CAS Number | 26244-71-3 |
|---|---|
| SMILES | CC(=O)CC(=O)NCCCl |
Product Overview
N-(2-Chloroethyl)-3-oxobutyramide (CAS 26244-71-3), with molecular formula C6H10ClNO2 and molecular weight 163.04 g/mol. IUPAC: N-(2-chloroethyl)-3-oxobutanamide.
Chemical Property Profile of N-(2-Chloroethyl)-3-oxobutyramide
Property Insights of N-(2-Chloroethyl)-3-oxobutyramide
The XLogP value of 0.3205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Chloroethyl)-3-oxobutyramide. With a topological polar surface area (TPSA) of 46.17 Ų, N-(2-Chloroethyl)-3-oxobutyramide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloroethyl)-3-oxobutyramide 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-Chloroethyl)-3-oxobutyramide?
The CAS number of N-(2-Chloroethyl)-3-oxobutyramide is 26244-71-3.
What is the molecular formula of N-(2-Chloroethyl)-3-oxobutyramide?
The molecular formula of N-(2-Chloroethyl)-3-oxobutyramide is C6H10ClNO2.
What is the molecular weight of N-(2-Chloroethyl)-3-oxobutyramide?
The molecular weight of N-(2-Chloroethyl)-3-oxobutyramide is 163.04 g/mol.
Where can I buy N-(2-Chloroethyl)-3-oxobutyramide?
You can request a quote for N-(2-Chloroethyl)-3-oxobutyramide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloroethyl)-3-oxobutyramide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)-3-oxobutyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.