Ethylmethylmalonic acid
TL;DR: Ethylmethylmalonic acid (CAS 595-84-6) is a chemical compound with molecular formula C6H10O4 and molecular weight 146.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2-methylpropanedioic acid
Also Known As: Ethylmethylmalonic acid, 2-ethyl-2-methylpropanedioic acid, Malonic acid, ethylmethyl-, Methylathylmalonsaure, ethyl(methyl)malonic acid
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 595-84-6 |
|---|---|
| SMILES | CCC(C)(C(=O)O)C(=O)O |
| InChIKey | OGAFKQWRXQJXJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethylmethylmalonic acid (CAS 595-84-6), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 2-ethyl-2-methylpropanedioic acid.
Chemical Property Profile of Ethylmethylmalonic acid
Property Insights of Ethylmethylmalonic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylmethylmalonic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethylmethylmalonic acid. Following Lipinski's Rule of Five, Ethylmethylmalonic 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 Ethylmethylmalonic acid?
The CAS number of Ethylmethylmalonic acid is 595-84-6.
What is the molecular formula of Ethylmethylmalonic acid?
The molecular formula of Ethylmethylmalonic acid is C6H10O4.
What is the molecular weight of Ethylmethylmalonic acid?
The molecular weight of Ethylmethylmalonic acid is 146.06 g/mol.
Where can I buy Ethylmethylmalonic acid?
You can request a quote for Ethylmethylmalonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylmethylmalonic acid?
Yes, KEHONG BIO provides custom synthesis services for Ethylmethylmalonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.