Butyl 2-acetyl-3-oxobutanoate
TL;DR: Butyl 2-acetyl-3-oxobutanoate (CAS 56346-04-4) is a chemical compound with molecular formula C10H16O4 and molecular weight 200.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-acetyl-3-oxobutanoate
Also Known As: butyl 2-acetyl-3-oxobutanoate, Butyl 2-acetyl-3-oxo-butanoate
| Molecular Formula | C10H16O4 |
|---|---|
| Molecular Weight | 200.10 g/mol |
| LogP | 1.1239 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 200.10486 |
| Heavy Atoms | 14 |
| Complexity | 218.2765 |
Chemical Identifiers
| CAS Number | 56346-04-4 |
|---|---|
| SMILES | CCCCOC(=O)C(C(=O)C)C(=O)C |
Product Overview
Butyl 2-acetyl-3-oxobutanoate (CAS 56346-04-4), with molecular formula C10H16O4 and molecular weight 200.10 g/mol. IUPAC: butyl 2-acetyl-3-oxobutanoate.
Chemical Property Profile of Butyl 2-acetyl-3-oxobutanoate
Property Insights of Butyl 2-acetyl-3-oxobutanoate
The XLogP value of 1.1239 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl 2-acetyl-3-oxobutanoate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Butyl 2-acetyl-3-oxobutanoate. Following Lipinski's Rule of Five, Butyl 2-acetyl-3-oxobutanoate 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 Butyl 2-acetyl-3-oxobutanoate?
The CAS number of Butyl 2-acetyl-3-oxobutanoate is 56346-04-4.
What is the molecular formula of Butyl 2-acetyl-3-oxobutanoate?
The molecular formula of Butyl 2-acetyl-3-oxobutanoate is C10H16O4.
What is the molecular weight of Butyl 2-acetyl-3-oxobutanoate?
The molecular weight of Butyl 2-acetyl-3-oxobutanoate is 200.10 g/mol.
Where can I buy Butyl 2-acetyl-3-oxobutanoate?
You can request a quote for Butyl 2-acetyl-3-oxobutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl 2-acetyl-3-oxobutanoate?
Yes, KEHONG BIO provides custom synthesis services for Butyl 2-acetyl-3-oxobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.