(Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid
TL;DR: (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid (CAS 191014-95-6) is a chemical compound with molecular formula C10H6Cl2O4 and molecular weight 259.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid
Also Known As: 2-Butenoic acid, 4-(3,4-dichlorophenyl)-2-hydroxy-4-oxo-, (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxo-but-3-enoic Acid
| Molecular Formula | C10H6Cl2O4 |
|---|---|
| Molecular Weight | 259.96 g/mol |
| LogP | 2.546 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.96432 |
| Heavy Atoms | 16 |
| Complexity | 479.70743 |
Chemical Identifiers
| CAS Number | 191014-95-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1/C(=C/C(=O)C(=O)O)/O)Cl)Cl |
Product Overview
(Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid (CAS 191014-95-6), with molecular formula C10H6Cl2O4 and molecular weight 259.96 g/mol. IUPAC: (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid.
Chemical Property Profile of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid
Property Insights of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid
The XLogP value of 2.546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid. Following Lipinski's Rule of Five, (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid has 2 hydrogen bond donor(s) and 3 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-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid?
The CAS number of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid is 191014-95-6.
What is the molecular formula of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid?
The molecular formula of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid is C10H6Cl2O4.
What is the molecular weight of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid?
The molecular weight of (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid is 259.96 g/mol.
Where can I buy (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid?
You can request a quote for (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic 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-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(3,4-dichlorophenyl)-4-hydroxy-2-oxobut-3-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.