2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester
TL;DR: 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester (CAS 521-52-8) is a chemical compound with molecular formula C19H14O5 and molecular weight 322.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(3,5-dioxo-4-phenyloxolan-2-ylidene)-2-phenylacetate
Also Known As: vulpinic acid, Spectrum2_000797, Spectrum3_001120, Spectrum4_001961, DivK1c_000754
| Molecular Formula | C19H14O5 |
|---|---|
| Molecular Weight | 322.08 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 69.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.08414 |
| Heavy Atoms | 24 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 521-52-8 |
|---|---|
| SMILES | COC(=O)C(=C1C(=O)C(C(=O)O1)C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | JOFTYVPERBCMPJ-UHFFFAOYSA-N |
Product Overview
2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester (CAS 521-52-8), with molecular formula C19H14O5 and molecular weight 322.08 g/mol. IUPAC: methyl 2-(3,5-dioxo-4-phenyloxolan-2-ylidene)-2-phenylacetate.
Chemical Property Profile of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester
Property Insights of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester
The XLogP value of 3.3 indicates that 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester 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 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester. Following Lipinski's Rule of Five, 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester 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 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester?
The CAS number of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester is 521-52-8.
What is the molecular formula of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester?
The molecular formula of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester is C19H14O5.
What is the molecular weight of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester?
The molecular weight of 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester is 322.08 g/mol.
Where can I buy 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester?
You can request a quote for 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-Dioxo-4-phenyl-2-oxolanylidene)-2-phenylacetic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.