cis-1,2-Dibenzoylethylene
TL;DR: cis-1,2-Dibenzoylethylene (CAS 959-27-3) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-1,4-diphenylbut-2-ene-1,4-dione
Also Known As: Dibenzoylethylene, cis-1,2-Dibenzoylethylene, cis-Dibenzoylethylene, cis-Diphenacyledene, (Z)-1,2-Dibenzoylethene
| Molecular Formula | C16H12O2 |
|---|---|
| Molecular Weight | 236.08 g/mol |
| LogP | 3.3084 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 236.08372 |
| Heavy Atoms | 18 |
| Complexity | 515.06067 |
Chemical Identifiers
| CAS Number | 959-27-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C=C\C(=O)C2=CC=CC=C2 |
Product Overview
cis-1,2-Dibenzoylethylene (CAS 959-27-3), with molecular formula C16H12O2 and molecular weight 236.08 g/mol. IUPAC: (Z)-1,4-diphenylbut-2-ene-1,4-dione.
Chemical Property Profile of cis-1,2-Dibenzoylethylene
Property Insights of cis-1,2-Dibenzoylethylene
The XLogP value of 3.3084 indicates that cis-1,2-Dibenzoylethylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, cis-1,2-Dibenzoylethylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-1,2-Dibenzoylethylene 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 cis-1,2-Dibenzoylethylene?
The CAS number of cis-1,2-Dibenzoylethylene is 959-27-3.
What is the molecular formula of cis-1,2-Dibenzoylethylene?
The molecular formula of cis-1,2-Dibenzoylethylene is C16H12O2.
What is the molecular weight of cis-1,2-Dibenzoylethylene?
The molecular weight of cis-1,2-Dibenzoylethylene is 236.08 g/mol.
Where can I buy cis-1,2-Dibenzoylethylene?
You can request a quote for cis-1,2-Dibenzoylethylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-1,2-Dibenzoylethylene?
Yes, KEHONG BIO provides custom synthesis services for cis-1,2-Dibenzoylethylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.