(1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate
TL;DR: (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate (CAS 7472-84-6) is a chemical compound with molecular formula C18H16O3 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-oxo-1,3-diphenylbut-3-en-2-yl) acetate
Also Known As: (1-oxo-1,3-diphenylbut-3-en-2-yl) acetate, 1-OXO-1,3-DIPHENYLBUT-3-EN-2-YL ACETATE
| Molecular Formula | C18H16O3 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 280.10995 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 7472-84-6 |
|---|---|
| SMILES | CC(=O)OC(C(=C)C1=CC=CC=C1)C(=O)C2=CC=CC=C2 |
| InChIKey | CAMSLRDAFQVKFA-UHFFFAOYSA-N |
Product Overview
(1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate (CAS 7472-84-6), with molecular formula C18H16O3 and molecular weight 280.11 g/mol. IUPAC: (1-oxo-1,3-diphenylbut-3-en-2-yl) acetate.
Chemical Property Profile of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate
Property Insights of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate
The XLogP value of 4.3 indicates that (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate has 0 hydrogen bond donor(s) and 3 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 (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate?
The CAS number of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate is 7472-84-6.
What is the molecular formula of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate?
The molecular formula of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate is C18H16O3.
What is the molecular weight of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate?
The molecular weight of (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate is 280.11 g/mol.
Where can I buy (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate?
You can request a quote for (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (1-Oxo-1,3-diphenylbut-3-en-2-yl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.