Ethylmalonic acid
TL;DR: Ethylmalonic acid (CAS 601-75-2) is a chemical compound with molecular formula C5H8O4 and molecular weight 132.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylpropanedioic acid
Also Known As: ETHYLMALONIC ACID, 2-Ethylmalonic acid, 2-ethylpropanedioic acid, Propanedioic acid, ethyl-, ethylmalonate
| Molecular Formula | C5H8O4 |
|---|---|
| Molecular Weight | 132.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 132.04225 |
| Heavy Atoms | 9 |
| Complexity | 115.0 |
| Melting Point | 112 - 114 °C |
| Solubility | 712.0 mg/mL |
Chemical Identifiers
| CAS Number | 601-75-2 |
|---|---|
| SMILES | CCC(C(=O)O)C(=O)O |
| InChIKey | UKFXDFUAPNAMPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethylmalonic acid (CAS 601-75-2), with molecular formula C5H8O4 and molecular weight 132.04 g/mol. IUPAC: 2-ethylpropanedioic acid.
Chemical Property Profile of Ethylmalonic acid
Property Insights of Ethylmalonic acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylmalonic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethylmalonic acid. Following Lipinski's Rule of Five, Ethylmalonic acid has 2 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 Ethylmalonic acid?
The CAS number of Ethylmalonic acid is 601-75-2.
What is the molecular formula of Ethylmalonic acid?
The molecular formula of Ethylmalonic acid is C5H8O4.
What is the molecular weight of Ethylmalonic acid?
The molecular weight of Ethylmalonic acid is 132.04 g/mol.
Where can I buy Ethylmalonic acid?
You can request a quote for Ethylmalonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylmalonic acid?
Yes, KEHONG BIO provides custom synthesis services for Ethylmalonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.