2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid
TL;DR: 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid (CAS 56382-90-2) 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.
2-benzhydrylidene-4-ethoxy-4-oxobutanoic acid
Also Known As: 2-(diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid, 2-benzhydrylidene-4-ethoxy-4-oxobutanoic acid, benzhydrylidene-succinic acid-4-ethyl ester, 2-benzhydrylidene-4-ethoxy-4-oxo-butanoic acid
| Molecular Formula | C19H18O4 |
|---|---|
| Molecular Weight | 310.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 310.1205 |
| Heavy Atoms | 23 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 56382-90-2 |
|---|---|
| SMILES | CCOC(=O)CC(=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)O |
| InChIKey | ZESSIJOQUZYQAV-UHFFFAOYSA-N |
Product Overview
2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid (CAS 56382-90-2), with molecular formula C19H18O4 and molecular weight 310.12 g/mol. IUPAC: 2-benzhydrylidene-4-ethoxy-4-oxobutanoic acid.
Chemical Property Profile of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid
Property Insights of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid
The XLogP value of 3.9 indicates that 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid. Following Lipinski's Rule of Five, 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid has 1 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-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid?
The CAS number of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid is 56382-90-2.
What is the molecular formula of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid?
The molecular formula of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid is C19H18O4.
What is the molecular weight of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid?
The molecular weight of 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid is 310.12 g/mol.
Where can I buy 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid?
You can request a quote for 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diphenylmethylidene)-4-ethoxy-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.