Methyl 2-acetyl-4-methyl-3-oxopentanoate
TL;DR: Methyl 2-acetyl-4-methyl-3-oxopentanoate (CAS 475662-06-7) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-acetyl-4-methyl-3-oxopentanoate
Also Known As: methyl 2-acetyl-4-methyl-3-oxopentanoate, Methyl 2-acetyl-4-methyl-3-oxo-pentanoate, methyl2-acetyl-4-methyl-3-oxopentanoate, 2-Acetyl-4-methyl-3-oxo-pentanoic acid methyl ester, 2-ACETYL-4-METHYL-3-OXO-PENTANOIC ACID METHYLESTER
| Molecular Formula | C9H14O4 |
|---|---|
| Molecular Weight | 186.09 g/mol |
| LogP | 0.5897 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.0892 |
| Heavy Atoms | 13 |
| Complexity | 229.7692 |
Chemical Identifiers
| CAS Number | 475662-06-7 |
|---|---|
| SMILES | CC(C)C(=O)C(C(=O)C)C(=O)OC |
Product Overview
Methyl 2-acetyl-4-methyl-3-oxopentanoate (CAS 475662-06-7), with molecular formula C9H14O4 and molecular weight 186.09 g/mol. IUPAC: methyl 2-acetyl-4-methyl-3-oxopentanoate.
Chemical Property Profile of Methyl 2-acetyl-4-methyl-3-oxopentanoate
Property Insights of Methyl 2-acetyl-4-methyl-3-oxopentanoate
The XLogP value of 0.5897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-acetyl-4-methyl-3-oxopentanoate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-acetyl-4-methyl-3-oxopentanoate. Following Lipinski's Rule of Five, Methyl 2-acetyl-4-methyl-3-oxopentanoate has 0 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 Methyl 2-acetyl-4-methyl-3-oxopentanoate?
The CAS number of Methyl 2-acetyl-4-methyl-3-oxopentanoate is 475662-06-7.
What is the molecular formula of Methyl 2-acetyl-4-methyl-3-oxopentanoate?
The molecular formula of Methyl 2-acetyl-4-methyl-3-oxopentanoate is C9H14O4.
What is the molecular weight of Methyl 2-acetyl-4-methyl-3-oxopentanoate?
The molecular weight of Methyl 2-acetyl-4-methyl-3-oxopentanoate is 186.09 g/mol.
Where can I buy Methyl 2-acetyl-4-methyl-3-oxopentanoate?
You can request a quote for Methyl 2-acetyl-4-methyl-3-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-acetyl-4-methyl-3-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-acetyl-4-methyl-3-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.