2-Ethyl-2-methylsuccinic acid
TL;DR: 2-Ethyl-2-methylsuccinic acid (CAS 631-31-2) is a chemical compound with molecular formula C7H12O4 and molecular weight 160.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-2-methylbutanedioic acid
Also Known As: 2-Ethyl-2-methylsuccinic acid, Isopimelic Acid, Metallibure, 2-ethyl-2-methylbutanedioic acid, Ethosuximide EP Impurity A
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 631-31-2 |
|---|---|
| SMILES | CCC(C)(CC(=O)O)C(=O)O |
| InChIKey | FDYJJKHDNNVUDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethyl-2-methylsuccinic acid (CAS 631-31-2), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: 2-ethyl-2-methylbutanedioic acid.
Chemical Property Profile of 2-Ethyl-2-methylsuccinic acid
Property Insights of 2-Ethyl-2-methylsuccinic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-2-methylsuccinic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethyl-2-methylsuccinic acid. Following Lipinski's Rule of Five, 2-Ethyl-2-methylsuccinic 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 2-Ethyl-2-methylsuccinic acid?
The CAS number of 2-Ethyl-2-methylsuccinic acid is 631-31-2.
What is the molecular formula of 2-Ethyl-2-methylsuccinic acid?
The molecular formula of 2-Ethyl-2-methylsuccinic acid is C7H12O4.
What is the molecular weight of 2-Ethyl-2-methylsuccinic acid?
The molecular weight of 2-Ethyl-2-methylsuccinic acid is 160.07 g/mol.
Where can I buy 2-Ethyl-2-methylsuccinic acid?
You can request a quote for 2-Ethyl-2-methylsuccinic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-2-methylsuccinic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-2-methylsuccinic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.