2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester
TL;DR: 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester (CAS 677326-75-9) is a chemical compound with molecular formula C19H18O4 and molecular weight 310.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-2-(4-phenylbenzoyl)butanoate
Also Known As: Not Available, Ethyl 3-oxo-2-(4-phenylbenzoyl)butanoate, 2-(biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester, 2-(BIPHENYL-4-CARBONYL)-3-OXO-BUTYRIC ACID ETHYLESTER, Ethyl 2-([1,1'-biphenyl]-4-carbonyl)-3-oxobutanoate
| Molecular Formula | C19H18O4 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 3.3046 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.1205 |
| Heavy Atoms | 23 |
| Complexity | 701.9093 |
Chemical Identifiers
| CAS Number | 677326-75-9 |
|---|---|
| SMILES | CCOC(=O)C(C(=O)C)C(=O)C1=CC=C(C=C1)C2=CC=CC=C2 |
Product Overview
2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester (CAS 677326-75-9), with molecular formula C19H18O4 and molecular weight 310.12 g/mol. IUPAC: ethyl 3-oxo-2-(4-phenylbenzoyl)butanoate.
Chemical Property Profile of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester
Property Insights of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester
The XLogP value of 3.3046 indicates that 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester. Following Lipinski's Rule of Five, 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester 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 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester?
The CAS number of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester is 677326-75-9.
What is the molecular formula of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester?
The molecular formula of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester is C19H18O4.
What is the molecular weight of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester?
The molecular weight of 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester is 310.12 g/mol.
Where can I buy 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester?
You can request a quote for 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-(Biphenyl-4-carbonyl)-3-oxo-butyric acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.