(E)-ethyl 4-styrylbenzoate
TL;DR: (E)-ethyl 4-styrylbenzoate (CAS 13252-06-7) is a chemical compound with molecular formula C17H16O2 and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(E)-2-phenylethenyl]benzoate
Also Known As: Ethyl Stilbene-4-carboxylate, (E)-ethyl 4-styrylbenzoate, Ethyl (E)-4-styrylbenzoate, 4-(Ethoxycarbonyl)stilbene, ethyl 4-(2-phenylvinyl)benzoate
| Molecular Formula | C17H16O2 |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 4.0337 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11504 |
| Heavy Atoms | 19 |
| Complexity | 553.57574 |
Chemical Identifiers
| CAS Number | 13252-06-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)/C=C/C2=CC=CC=C2 |
Product Overview
(E)-ethyl 4-styrylbenzoate (CAS 13252-06-7), with molecular formula C17H16O2 and molecular weight 252.12 g/mol. IUPAC: ethyl 4-[(E)-2-phenylethenyl]benzoate.
Chemical Property Profile of (E)-ethyl 4-styrylbenzoate
Property Insights of (E)-ethyl 4-styrylbenzoate
The XLogP value of 4.0337 indicates that (E)-ethyl 4-styrylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (E)-ethyl 4-styrylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-ethyl 4-styrylbenzoate has 0 hydrogen bond donor(s) and 2 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 (E)-ethyl 4-styrylbenzoate?
The CAS number of (E)-ethyl 4-styrylbenzoate is 13252-06-7.
What is the molecular formula of (E)-ethyl 4-styrylbenzoate?
The molecular formula of (E)-ethyl 4-styrylbenzoate is C17H16O2.
What is the molecular weight of (E)-ethyl 4-styrylbenzoate?
The molecular weight of (E)-ethyl 4-styrylbenzoate is 252.12 g/mol.
Where can I buy (E)-ethyl 4-styrylbenzoate?
You can request a quote for (E)-ethyl 4-styrylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 4-styrylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 4-styrylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.