3-Acetoxy-1,3-diphenylpropene
TL;DR: 3-Acetoxy-1,3-diphenylpropene (CAS 87751-69-7) 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.
1,3-diphenylprop-2-enyl acetate
Also Known As: 3-acetoxy-1,3-diphenylpropene, 1,3-diphenylprop-2-enyl acetate, (e)-1,3-diphenylallyl acetate, 1,3-diphenyl-2-propenyl acetate, rac-1,3-diphenyl-2-propenyl acetate
| Molecular Formula | C17H16O2 |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 252.11504 |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 87751-69-7 |
|---|---|
| SMILES | CC(=O)OC(C=CC1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | UVJZGFKZGQSKDV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetoxy-1,3-diphenylpropene (CAS 87751-69-7), with molecular formula C17H16O2 and molecular weight 252.12 g/mol. IUPAC: 1,3-diphenylprop-2-enyl acetate.
Chemical Property Profile of 3-Acetoxy-1,3-diphenylpropene
Property Insights of 3-Acetoxy-1,3-diphenylpropene
The XLogP value of 3.9 indicates that 3-Acetoxy-1,3-diphenylpropene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Acetoxy-1,3-diphenylpropene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetoxy-1,3-diphenylpropene 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 3-Acetoxy-1,3-diphenylpropene?
The CAS number of 3-Acetoxy-1,3-diphenylpropene is 87751-69-7.
What is the molecular formula of 3-Acetoxy-1,3-diphenylpropene?
The molecular formula of 3-Acetoxy-1,3-diphenylpropene is C17H16O2.
What is the molecular weight of 3-Acetoxy-1,3-diphenylpropene?
The molecular weight of 3-Acetoxy-1,3-diphenylpropene is 252.12 g/mol.
Where can I buy 3-Acetoxy-1,3-diphenylpropene?
You can request a quote for 3-Acetoxy-1,3-diphenylpropene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetoxy-1,3-diphenylpropene?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetoxy-1,3-diphenylpropene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.