3-Methylglutaric acid
TL;DR: 3-Methylglutaric acid (CAS 626-51-7) 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.
3-methylpentanedioic acid
Also Known As: 3-METHYLGLUTARIC ACID, 3-Methylpentanedioic acid, Methylglutaric acid, Pentanedioic acid, 3-methyl-, Methylglutarate
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 146.0579 |
| Heavy Atoms | 10 |
| Complexity | 125.0 |
| Melting Point | 80 - 82 °C |
Chemical Identifiers
| CAS Number | 626-51-7 |
|---|---|
| SMILES | CC(CC(=O)O)CC(=O)O |
| InChIKey | XJMMNTGIMDZPMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylglutaric acid (CAS 626-51-7), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 3-methylpentanedioic acid.
Chemical Property Profile of 3-Methylglutaric acid
Property Insights of 3-Methylglutaric acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylglutaric acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methylglutaric acid. Following Lipinski's Rule of Five, 3-Methylglutaric 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 3-Methylglutaric acid?
The CAS number of 3-Methylglutaric acid is 626-51-7.
What is the molecular formula of 3-Methylglutaric acid?
The molecular formula of 3-Methylglutaric acid is C6H10O4.
What is the molecular weight of 3-Methylglutaric acid?
The molecular weight of 3-Methylglutaric acid is 146.06 g/mol.
Where can I buy 3-Methylglutaric acid?
You can request a quote for 3-Methylglutaric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylglutaric acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylglutaric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.