2,4-Dichloro-5-oxo-2-hexenedioic acid
TL;DR: 2,4-Dichloro-5-oxo-2-hexenedioic acid (CAS 56771-78-9) is a chemical compound with molecular formula C6H4Cl2O5 and molecular weight 225.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dichloro-5-oxohex-2-enedioic acid
Also Known As: 2,4-Dichloro-5-oxohex-2-enedioic acid, 2,4-Dichloro-5-oxo-2-hexenedioic acid
| Molecular Formula | C6H4Cl2O5 |
|---|---|
| Molecular Weight | 225.94 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.94357 |
| Heavy Atoms | 13 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 56771-78-9 |
|---|---|
| SMILES | C(=C(C(=O)O)Cl)C(C(=O)C(=O)O)Cl |
| InChIKey | FZNLPNDNOQEIGH-UHFFFAOYSA-N |
Product Overview
2,4-Dichloro-5-oxo-2-hexenedioic acid (CAS 56771-78-9), with molecular formula C6H4Cl2O5 and molecular weight 225.94 g/mol. IUPAC: 2,4-dichloro-5-oxohex-2-enedioic acid.
Chemical Property Profile of 2,4-Dichloro-5-oxo-2-hexenedioic acid
Property Insights of 2,4-Dichloro-5-oxo-2-hexenedioic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dichloro-5-oxo-2-hexenedioic acid. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dichloro-5-oxo-2-hexenedioic acid. Following Lipinski's Rule of Five, 2,4-Dichloro-5-oxo-2-hexenedioic acid has 2 hydrogen bond donor(s) and 5 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 2,4-Dichloro-5-oxo-2-hexenedioic acid?
The CAS number of 2,4-Dichloro-5-oxo-2-hexenedioic acid is 56771-78-9.
What is the molecular formula of 2,4-Dichloro-5-oxo-2-hexenedioic acid?
The molecular formula of 2,4-Dichloro-5-oxo-2-hexenedioic acid is C6H4Cl2O5.
What is the molecular weight of 2,4-Dichloro-5-oxo-2-hexenedioic acid?
The molecular weight of 2,4-Dichloro-5-oxo-2-hexenedioic acid is 225.94 g/mol.
Where can I buy 2,4-Dichloro-5-oxo-2-hexenedioic acid?
You can request a quote for 2,4-Dichloro-5-oxo-2-hexenedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dichloro-5-oxo-2-hexenedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dichloro-5-oxo-2-hexenedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.