Dibenzalacetone, (1Z,4E)-
TL;DR: Dibenzalacetone, (1Z,4E)- (CAS 52409-22-0) is a chemical compound with molecular formula C17H14O and molecular weight 234.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z,4E)-1,5-diphenylpenta-1,4-dien-3-one
Also Known As: Dibenzalacetone, Styrol ketone, Distyryl ketone, Dibenzylideneacetone, cis,trans-Dibenzylideneacetone
| Molecular Formula | C17H14O |
|---|---|
| Molecular Weight | 234.10 g/mol |
| LogP | 3.9823 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 234.10446 |
| Heavy Atoms | 18 |
| Complexity | 499.17868 |
Chemical Identifiers
| CAS Number | 52409-22-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C(=O)/C=C\C2=CC=CC=C2 |
Product Overview
Dibenzalacetone, (1Z,4E)- (CAS 52409-22-0), with molecular formula C17H14O and molecular weight 234.10 g/mol. IUPAC: (1Z,4E)-1,5-diphenylpenta-1,4-dien-3-one.
Chemical Property Profile of Dibenzalacetone, (1Z,4E)-
Property Insights of Dibenzalacetone, (1Z,4E)-
The XLogP value of 3.9823 indicates that Dibenzalacetone, (1Z,4E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Dibenzalacetone, (1Z,4E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzalacetone, (1Z,4E)- has 0 hydrogen bond donor(s) and 1 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 Dibenzalacetone, (1Z,4E)-?
The CAS number of Dibenzalacetone, (1Z,4E)- is 52409-22-0.
What is the molecular formula of Dibenzalacetone, (1Z,4E)-?
The molecular formula of Dibenzalacetone, (1Z,4E)- is C17H14O.
What is the molecular weight of Dibenzalacetone, (1Z,4E)-?
The molecular weight of Dibenzalacetone, (1Z,4E)- is 234.10 g/mol.
Where can I buy Dibenzalacetone, (1Z,4E)-?
You can request a quote for Dibenzalacetone, (1Z,4E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzalacetone, (1Z,4E)-?
Yes, KEHONG BIO provides custom synthesis services for Dibenzalacetone, (1Z,4E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.