Dicinnamalacetone
TL;DR: Dicinnamalacetone (CAS 153788-49-9) is a chemical compound with molecular formula C21H18O and molecular weight 286.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1E,3E,6E,8E)-1,9-diphenylnona-1,3,6,8-tetraen-5-one
Also Known As: Dicinnamalacetone, 1,9-Diphenyl-1,3,6,8-nonatetraen-5-one, Dicinnamylideneacetone, Acetone, dicinnamylidene-, 2-Ethyl-1-hexylamine
Technical Specifications
| Molecular Formula | C21H18O |
| Molecular Weight | 286.13577 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 286.13577 Da |
| Heavy Atoms | 22 |
| Complexity | 387.0 |
| SMILES | C1=CC=C(C=C1)/C=C/C=C/C(=O)/C=C/C=C/C2=CC=CC=C2 |
| InChIKey | RLJALOQFYHCJKG-FVRNMFRHSA-N |
Chemical Property Profile of Dicinnamalacetone
Property Insights of Dicinnamalacetone
The XLogP value of 5.4 indicates that Dicinnamalacetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Dicinnamalacetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dicinnamalacetone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dicinnamalacetone?
The CAS number of Dicinnamalacetone is 153788-49-9.
What is the molecular formula of Dicinnamalacetone?
The molecular formula of Dicinnamalacetone is C21H18O.
What is the molecular weight of Dicinnamalacetone?
The molecular weight of Dicinnamalacetone is 286.13577 g/mol.
Where can I buy Dicinnamalacetone?
You can request a quote for Dicinnamalacetone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dicinnamalacetone?
Yes, CoreyChem provides custom synthesis services for Dicinnamalacetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.