Isopropylmalonic acid
TL;DR: Isopropylmalonic acid (CAS 601-79-6) 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-propan-2-ylpropanedioic acid
Also Known As: Isopropylmalonic acid, 2-Isopropylmalonic acid, Malonic acid, isopropyl-, Isopropylmalonsaure, Propanedioic acid, (1-methylethyl)-
| Molecular Formula | C6H10O4 |
|---|---|
| Molecular Weight | 146.06 g/mol |
| LogP | 0.9 |
| 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 | 136.0 |
Chemical Identifiers
| CAS Number | 601-79-6 |
|---|---|
| SMILES | CC(C)C(C(=O)O)C(=O)O |
| InChIKey | DQEUFPARIOFOAI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropylmalonic acid (CAS 601-79-6), with molecular formula C6H10O4 and molecular weight 146.06 g/mol. IUPAC: 2-propan-2-ylpropanedioic acid.
Chemical Property Profile of Isopropylmalonic acid
Property Insights of Isopropylmalonic acid
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylmalonic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Isopropylmalonic acid. Following Lipinski's Rule of Five, Isopropylmalonic 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 Isopropylmalonic acid?
The CAS number of Isopropylmalonic acid is 601-79-6.
What is the molecular formula of Isopropylmalonic acid?
The molecular formula of Isopropylmalonic acid is C6H10O4.
What is the molecular weight of Isopropylmalonic acid?
The molecular weight of Isopropylmalonic acid is 146.06 g/mol.
Where can I buy Isopropylmalonic acid?
You can request a quote for Isopropylmalonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropylmalonic acid?
Yes, KEHONG BIO provides custom synthesis services for Isopropylmalonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.