5-Methoxy-4-methyl-5-oxopentanoic acid
TL;DR: 5-Methoxy-4-methyl-5-oxopentanoic acid (CAS 72088-36-9) 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.
5-methoxy-4-methyl-5-oxopentanoic acid
Also Known As: 5-Methoxy-4-methyl-5-oxopentanoic acid, 4-methoxycarbonylpentanoic acid, 2-Methylpentanedioicacidmonomethylester, 5-keto-5-methoxy-4-methyl-valeric acid, 5-Methoxy-4-methyl-5-oxopentanoic acid #
| Molecular Formula | C7H12O4 |
|---|---|
| Molecular Weight | 160.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 160.07356 |
| Heavy Atoms | 11 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 72088-36-9 |
|---|---|
| SMILES | CC(CCC(=O)O)C(=O)OC |
| InChIKey | GPERFEGHZZLCRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methoxy-4-methyl-5-oxopentanoic acid (CAS 72088-36-9), with molecular formula C7H12O4 and molecular weight 160.07 g/mol. IUPAC: 5-methoxy-4-methyl-5-oxopentanoic acid.
Chemical Property Profile of 5-Methoxy-4-methyl-5-oxopentanoic acid
Property Insights of 5-Methoxy-4-methyl-5-oxopentanoic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-4-methyl-5-oxopentanoic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methoxy-4-methyl-5-oxopentanoic acid. Following Lipinski's Rule of Five, 5-Methoxy-4-methyl-5-oxopentanoic acid has 1 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 5-Methoxy-4-methyl-5-oxopentanoic acid?
The CAS number of 5-Methoxy-4-methyl-5-oxopentanoic acid is 72088-36-9.
What is the molecular formula of 5-Methoxy-4-methyl-5-oxopentanoic acid?
The molecular formula of 5-Methoxy-4-methyl-5-oxopentanoic acid is C7H12O4.
What is the molecular weight of 5-Methoxy-4-methyl-5-oxopentanoic acid?
The molecular weight of 5-Methoxy-4-methyl-5-oxopentanoic acid is 160.07 g/mol.
Where can I buy 5-Methoxy-4-methyl-5-oxopentanoic acid?
You can request a quote for 5-Methoxy-4-methyl-5-oxopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-4-methyl-5-oxopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-4-methyl-5-oxopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.