Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate
TL;DR: Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate (CAS 102433-59-0) is a chemical compound with molecular formula C19H26O5 and molecular weight 334.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(4-methyl-3-oxo-1-phenylpentyl)propanedioate
Also Known As: diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate, Diethyl (4-methyl-3-oxo-1-phenylpentyl)propanedioate, diethyl 2-(4-methyl-3-oxo-1-phenylpentyl)propanedioate, DIETHYL 2-(4-METHYL-3-OXO-1-PHENYL-PENTYL)PROPANEDIOATE
| Molecular Formula | C19H26O5 |
|---|---|
| Molecular Weight | 334.18 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 334.178 |
| Heavy Atoms | 24 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 102433-59-0 |
|---|---|
| SMILES | CCOC(=O)C(C(CC(=O)C(C)C)C1=CC=CC=C1)C(=O)OCC |
| InChIKey | OSJMHLPXXZNODR-UHFFFAOYSA-N |
Product Overview
Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate (CAS 102433-59-0), with molecular formula C19H26O5 and molecular weight 334.18 g/mol. IUPAC: diethyl 2-(4-methyl-3-oxo-1-phenylpentyl)propanedioate.
Chemical Property Profile of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate
Property Insights of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate
The XLogP value of 3.4 indicates that Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate. Following Lipinski's Rule of Five, Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate has 0 hydrogen bond donor(s) and 5 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 Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate?
The CAS number of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate is 102433-59-0.
What is the molecular formula of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate?
The molecular formula of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate is C19H26O5.
What is the molecular weight of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate?
The molecular weight of Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate is 334.18 g/mol.
Where can I buy Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate?
You can request a quote for Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl(4-methyl-3-oxo-1-phenylpentyl)propanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.