(Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid
TL;DR: (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid (CAS 111230-59-2) is a chemical compound with molecular formula C5H6ClNO4 and molecular weight 179.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-4-chloro-2-methoxyimino-3-oxobutanoic acid
Also Known As: (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid, 8780AC, (2Z)-4-chloro-2-methoxyimino-3-oxo-butanoic Acid, I14-38829, (Z)-4-CHLORO-2-METHOXYIMINO-3-OXOBUTANOIC ACID
| Molecular Formula | C5H6ClNO4 |
|---|---|
| Molecular Weight | 179.00 g/mol |
| LogP | -0.1187 |
| Topological Polar Surface Area | 75.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 178.99854 |
| Heavy Atoms | 11 |
| Complexity | 200.6591 |
Chemical Identifiers
| CAS Number | 111230-59-2 |
|---|---|
| SMILES | CO/N=C(/C(=O)CCl)\C(=O)O |
Product Overview
(Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid (CAS 111230-59-2), with molecular formula C5H6ClNO4 and molecular weight 179.00 g/mol. IUPAC: (2Z)-4-chloro-2-methoxyimino-3-oxobutanoic acid.
Chemical Property Profile of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid
Property Insights of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid
The XLogP value of -0.1187 indicates that (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.96 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid. Following Lipinski's Rule of Five, (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid 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 (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid?
The CAS number of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid is 111230-59-2.
What is the molecular formula of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid?
The molecular formula of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid is C5H6ClNO4.
What is the molecular weight of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid?
The molecular weight of (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid is 179.00 g/mol.
Where can I buy (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid?
You can request a quote for (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-Chloro-2-(methoxyimino)-3-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.