1-(3,4-Dichlorophenyl)ethan-1-one oxime
TL;DR: 1-(3,4-Dichlorophenyl)ethan-1-one oxime (CAS 139752-39-9) is a chemical compound with molecular formula C8H7Cl2NO and molecular weight 202.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(NE)-N-[1-(3,4-dichlorophenyl)ethylidene]hydroxylamine
Also Known As: 1-(3,4-dichlorophenyl)ethan-1-one oxime, 3',4'-Dichloroacetophenone oxime, 1-(3,4-Dichlorophenyl)ethanone oxime, 1-(3,4-Dichlorophenyl)ethanoneoxime, 3 ,4 -Dichloroacetophenoneoxime
| Molecular Formula | C8H7Cl2NO |
|---|---|
| Molecular Weight | 202.99 g/mol |
| LogP | 3.1916 |
| Topological Polar Surface Area | 32.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 202.99046 |
| Heavy Atoms | 12 |
| Complexity | 322.83395 |
Chemical Identifiers
| CAS Number | 139752-39-9 |
|---|---|
| SMILES | C/C(=N\O)/C1=CC(=C(C=C1)Cl)Cl |
Product Overview
1-(3,4-Dichlorophenyl)ethan-1-one oxime (CAS 139752-39-9), with molecular formula C8H7Cl2NO and molecular weight 202.99 g/mol. IUPAC: (NE)-N-[1-(3,4-dichlorophenyl)ethylidene]hydroxylamine.
Chemical Property Profile of 1-(3,4-Dichlorophenyl)ethan-1-one oxime
Property Insights of 1-(3,4-Dichlorophenyl)ethan-1-one oxime
The XLogP value of 3.1916 indicates that 1-(3,4-Dichlorophenyl)ethan-1-one oxime is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.59 Ų, 1-(3,4-Dichlorophenyl)ethan-1-one oxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dichlorophenyl)ethan-1-one 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-(3,4-Dichlorophenyl)ethan-1-one oxime?
The CAS number of 1-(3,4-Dichlorophenyl)ethan-1-one oxime is 139752-39-9.
What is the molecular formula of 1-(3,4-Dichlorophenyl)ethan-1-one oxime?
The molecular formula of 1-(3,4-Dichlorophenyl)ethan-1-one oxime is C8H7Cl2NO.
What is the molecular weight of 1-(3,4-Dichlorophenyl)ethan-1-one oxime?
The molecular weight of 1-(3,4-Dichlorophenyl)ethan-1-one oxime is 202.99 g/mol.
Where can I buy 1-(3,4-Dichlorophenyl)ethan-1-one oxime?
You can request a quote for 1-(3,4-Dichlorophenyl)ethan-1-one oxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,4-Dichlorophenyl)ethan-1-one oxime?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,4-Dichlorophenyl)ethan-1-one oxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.