Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate
TL;DR: Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate (CAS 94580-73-1) is a chemical compound with molecular formula C20H20O4 and molecular weight 324.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate
Also Known As: ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate, ethyl 4-phenyl-3-[(phenylacetyl)oxy]-3-butenoate
| Molecular Formula | C20H20O4 |
|---|---|
| Molecular Weight | 324.14 g/mol |
| LogP | 3.7666 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 324.13617 |
| Heavy Atoms | 24 |
| Complexity | 690.0935 |
Chemical Identifiers
| CAS Number | 94580-73-1 |
|---|---|
| SMILES | CCOC(=O)CC(=CC1=CC=CC=C1)OC(=O)CC2=CC=CC=C2 |
Product Overview
Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate (CAS 94580-73-1), with molecular formula C20H20O4 and molecular weight 324.14 g/mol. IUPAC: ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate.
Chemical Property Profile of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate
Property Insights of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate
The XLogP value of 3.7666 indicates that Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate 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 Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate?
The CAS number of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate is 94580-73-1.
What is the molecular formula of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate?
The molecular formula of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate is C20H20O4.
What is the molecular weight of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate?
The molecular weight of Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate is 324.14 g/mol.
Where can I buy Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate?
You can request a quote for Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-phenyl-3-(2-phenylacetyl)oxybut-3-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.