1-(4-Chlorophenyl)-1-ethanone oxime
TL;DR: 1-(4-Chlorophenyl)-1-ethanone oxime (CAS 2002-40-6) 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.
(NE)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine
Also Known As: 1-(4-Chlorophenyl)ethanone oxime, 4-Chloroacetophenone oxime, p-Chloroacetophenone oxime, 1-(4-chlorophenyl)-1-ethanone oxime, 4'-Chloroacetophenone oxime
| Molecular Formula | C8H8ClNO |
|---|---|
| Molecular Weight | 169.03 g/mol |
| LogP | 2.5382 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.02943 |
| Heavy Atoms | 11 |
| Complexity | 265.92548 |
Chemical Identifiers
| CAS Number | 2002-40-6 |
|---|---|
| SMILES | C/C(=N\O)/C1=CC=C(C=C1)Cl |
Product Overview
1-(4-Chlorophenyl)-1-ethanone oxime (CAS 2002-40-6), with molecular formula C8H8ClNO and molecular weight 169.03 g/mol. IUPAC: (NE)-N-[1-(4-chlorophenyl)ethylidene]hydroxylamine.
Chemical Property Profile of 1-(4-Chlorophenyl)-1-ethanone oxime
Property Insights of 1-(4-Chlorophenyl)-1-ethanone oxime
The XLogP value of 2.5382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorophenyl)-1-ethanone oxime. With a topological polar surface area (TPSA) of 32.59 Ų, 1-(4-Chlorophenyl)-1-ethanone oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-1-ethanone 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 1-(4-Chlorophenyl)-1-ethanone oxime?
The CAS number of 1-(4-Chlorophenyl)-1-ethanone oxime is 2002-40-6.
What is the molecular formula of 1-(4-Chlorophenyl)-1-ethanone oxime?
The molecular formula of 1-(4-Chlorophenyl)-1-ethanone oxime is C8H8ClNO.
What is the molecular weight of 1-(4-Chlorophenyl)-1-ethanone oxime?
The molecular weight of 1-(4-Chlorophenyl)-1-ethanone oxime is 169.03 g/mol.
Where can I buy 1-(4-Chlorophenyl)-1-ethanone oxime?
You can request a quote for 1-(4-Chlorophenyl)-1-ethanone oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorophenyl)-1-ethanone oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorophenyl)-1-ethanone oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.