2-Methyl-2-pentenedioic acid
TL;DR: 2-Methyl-2-pentenedioic acid (CAS 53358-22-8) is a chemical compound with molecular formula C6H8O4 and molecular weight 144.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpent-2-enedioic acid
Also Known As: methylglutaconic acid, 2-Methylglutaconic acid, 2-methylpent-2-enedioic acid, 2-methylpent-2-enedioicacid, 2-METHYL-2-PENTENEDIOIC ACID
| Molecular Formula | C6H8O4 |
|---|---|
| Molecular Weight | 144.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 144.04225 |
| Heavy Atoms | 10 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 53358-22-8 |
|---|---|
| SMILES | CC(=CCC(=O)O)C(=O)O |
| InChIKey | JKGHDBJDBRBRNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-2-pentenedioic acid (CAS 53358-22-8), with molecular formula C6H8O4 and molecular weight 144.04 g/mol. IUPAC: 2-methylpent-2-enedioic acid.
Chemical Property Profile of 2-Methyl-2-pentenedioic acid
Property Insights of 2-Methyl-2-pentenedioic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-pentenedioic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-2-pentenedioic acid. Following Lipinski's Rule of Five, 2-Methyl-2-pentenedioic 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-Methyl-2-pentenedioic acid?
The CAS number of 2-Methyl-2-pentenedioic acid is 53358-22-8.
What is the molecular formula of 2-Methyl-2-pentenedioic acid?
The molecular formula of 2-Methyl-2-pentenedioic acid is C6H8O4.
What is the molecular weight of 2-Methyl-2-pentenedioic acid?
The molecular weight of 2-Methyl-2-pentenedioic acid is 144.04 g/mol.
Where can I buy 2-Methyl-2-pentenedioic acid?
You can request a quote for 2-Methyl-2-pentenedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-pentenedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-pentenedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.