3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one
TL;DR: 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one (CAS 844446-62-4) is a chemical compound with molecular formula C20H14ClF3O3 and molecular weight 394.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-7-(2-methylprop-2-enoxy)-2-(trifluoromethyl)chromen-4-one
Also Known As: 3-(4-chlorophenyl)-7-((2-methylallyl)oxy)-2-(trifluoromethyl)-4H-chromen-4-one, 3-(4-chlorophenyl)-7-(2-methylprop-2-enoxy)-2-(trifluoromethyl)chromen-4-one, 3-(4-chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one, 3-(4-chlorophenyl)-7-[(2-methylprop-2-en-1-yl)oxy]-2-(trifluoromethyl)-4H-chromen-4-one
| Molecular Formula | C20H14ClF3O3 |
|---|---|
| Molecular Weight | 394.06 g/mol |
| LogP | 6.0871 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.05835 |
| Heavy Atoms | 27 |
| Complexity | 1066.7526 |
Chemical Identifiers
| CAS Number | 844446-62-4 |
|---|---|
| SMILES | CC(=C)COC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one (CAS 844446-62-4), with molecular formula C20H14ClF3O3 and molecular weight 394.06 g/mol. IUPAC: 3-(4-chlorophenyl)-7-(2-methylprop-2-enoxy)-2-(trifluoromethyl)chromen-4-one.
Chemical Property Profile of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one
Property Insights of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one
The XLogP value of 6.0871 indicates that 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one?
The CAS number of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one is 844446-62-4.
What is the molecular formula of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one?
The molecular formula of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one is C20H14ClF3O3.
What is the molecular weight of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one?
The molecular weight of 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one is 394.06 g/mol.
Where can I buy 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one?
You can request a quote for 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-7-(2-methylprop-2-enyloxy)-2-(trifluoromethyl)chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.