Cinnamoylbenzene
TL;DR: Cinnamoylbenzene (CAS 94-41-7) is a chemical compound with molecular formula C15H12O and molecular weight 208.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diphenylprop-2-en-1-one
Also Known As: Chalcone, trans-Chalcone, Benzalacetophenone, Cinnamoylbenzene, (E)-Chalcone
| Molecular Formula | C15H12O |
|---|---|
| Molecular Weight | 208.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.08882 |
| Heavy Atoms | 16 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 94-41-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2 |
| InChIKey | DQFBYFPFKXHELB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cinnamoylbenzene (CAS 94-41-7), with molecular formula C15H12O and molecular weight 208.09 g/mol. IUPAC: 1,3-diphenylprop-2-en-1-one.
Chemical Property Profile of Cinnamoylbenzene
Property Insights of Cinnamoylbenzene
The XLogP value of 3.1 indicates that Cinnamoylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Cinnamoylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamoylbenzene 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 Cinnamoylbenzene?
The CAS number of Cinnamoylbenzene is 94-41-7.
What is the molecular formula of Cinnamoylbenzene?
The molecular formula of Cinnamoylbenzene is C15H12O.
What is the molecular weight of Cinnamoylbenzene?
The molecular weight of Cinnamoylbenzene is 208.09 g/mol.
Where can I buy Cinnamoylbenzene?
You can request a quote for Cinnamoylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamoylbenzene?
Yes, KEHONG BIO provides custom synthesis services for Cinnamoylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.