Propyl 2,4-dioxovalerate
TL;DR: Propyl 2,4-dioxovalerate (CAS 39526-01-7) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2,4-dioxopentanoate
Also Known As: Propyl 2,4-dioxovalerate, propyl 2,4-dioxopentanoate, propyl2,4-dioxovalerate, EINECS 254-493-4, 2,4-Dioxopentanoic acid propyl ester
| Molecular Formula | C8H12O4 |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 0.4878 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 172.07356 |
| Heavy Atoms | 12 |
| Complexity | 195.23454 |
Chemical Identifiers
| CAS Number | 39526-01-7 |
|---|---|
| SMILES | CCCOC(=O)C(=O)CC(=O)C |
Product Overview
Propyl 2,4-dioxovalerate (CAS 39526-01-7), with molecular formula C8H12O4 and molecular weight 172.07 g/mol. IUPAC: propyl 2,4-dioxopentanoate.
Chemical Property Profile of Propyl 2,4-dioxovalerate
Property Insights of Propyl 2,4-dioxovalerate
The XLogP value of 0.4878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 2,4-dioxovalerate. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 2,4-dioxovalerate. Following Lipinski's Rule of Five, Propyl 2,4-dioxovalerate 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 Propyl 2,4-dioxovalerate?
The CAS number of Propyl 2,4-dioxovalerate is 39526-01-7.
What is the molecular formula of Propyl 2,4-dioxovalerate?
The molecular formula of Propyl 2,4-dioxovalerate is C8H12O4.
What is the molecular weight of Propyl 2,4-dioxovalerate?
The molecular weight of Propyl 2,4-dioxovalerate is 172.07 g/mol.
Where can I buy Propyl 2,4-dioxovalerate?
You can request a quote for Propyl 2,4-dioxovalerate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 2,4-dioxovalerate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 2,4-dioxovalerate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.