2-Chloro-1-phenylethanone oxime
TL;DR: 2-Chloro-1-phenylethanone oxime (CAS 21572-32-7) is a chemical compound with molecular formula C8H8ClNO and molecular weight 169.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-1-phenylethylidene)hydroxylamine
Also Known As: Ethanone, 2-chloro-1-phenyl-, oxime, N-(2-chloro-1-phenylethylidene)hydroxylamine, 2-Chloro-1-phenylethanone oxime, 2-Chlor-1-phenyl-aethanon-oxim, 2-chloro-1-phenyl-ethanone oxime
| Molecular Formula | C8H8ClNO |
|---|---|
| Molecular Weight | 169.03 g/mol |
| LogP | 2.1037 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 169.02943 |
| Heavy Atoms | 11 |
| Complexity | 245.5288 |
Chemical Identifiers
| CAS Number | 21572-32-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NO)CCl |
Product Overview
2-Chloro-1-phenylethanone oxime (CAS 21572-32-7), with molecular formula C8H8ClNO and molecular weight 169.03 g/mol. IUPAC: N-(2-chloro-1-phenylethylidene)hydroxylamine.
Chemical Property Profile of 2-Chloro-1-phenylethanone oxime
Property Insights of 2-Chloro-1-phenylethanone oxime
The XLogP value of 2.1037 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1-phenylethanone oxime. With a topological polar surface area (TPSA) of 32.59 Ų, 2-Chloro-1-phenylethanone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-phenylethanone oxime 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 2-Chloro-1-phenylethanone oxime?
The CAS number of 2-Chloro-1-phenylethanone oxime is 21572-32-7.
What is the molecular formula of 2-Chloro-1-phenylethanone oxime?
The molecular formula of 2-Chloro-1-phenylethanone oxime is C8H8ClNO.
What is the molecular weight of 2-Chloro-1-phenylethanone oxime?
The molecular weight of 2-Chloro-1-phenylethanone oxime is 169.03 g/mol.
Where can I buy 2-Chloro-1-phenylethanone oxime?
You can request a quote for 2-Chloro-1-phenylethanone oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-phenylethanone oxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-phenylethanone oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.