Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-
TL;DR: Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- (CAS 35444-07-6) is a chemical compound with molecular formula C15H8F6O and molecular weight 318.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,4-trifluoro-1-naphthalen-1-yl-3-(trifluoromethyl)but-2-en-1-one
Also Known As: 1-(1-Naphthyl)-4,4,4-trifluoro-3-trifluoromethyl-2-buten-1-one, 4,4,4-Trifluoro-3-trifluoromethyl-2-buteno-1'-naphthone, 2-Buteno-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-, CROTONO-1'-NAPHTHONE, 4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-, 4,4,4-trifluoro-1-(naphthalen-1-yl)-3-(trifluoromethyl)but-2-en-1-one
| Molecular Formula | C15H8F6O |
|---|---|
| Molecular Weight | 318.05 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 318.04794 |
| Heavy Atoms | 22 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 35444-07-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C(=O)C=C(C(F)(F)F)C(F)(F)F |
| InChIKey | PKHVJLVMWILAIX-UHFFFAOYSA-N |
Product Overview
Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- (CAS 35444-07-6), with molecular formula C15H8F6O and molecular weight 318.05 g/mol. IUPAC: 4,4,4-trifluoro-1-naphthalen-1-yl-3-(trifluoromethyl)but-2-en-1-one.
Chemical Property Profile of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-
Property Insights of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-
The XLogP value of 5.3 indicates that Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-?
The CAS number of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- is 35444-07-6.
What is the molecular formula of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-?
The molecular formula of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- is C15H8F6O.
What is the molecular weight of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-?
The molecular weight of Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- is 318.05 g/mol.
Where can I buy Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-?
You can request a quote for Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl-?
Yes, KEHONG BIO provides custom synthesis services for Crotono-1'-naphthone, 4,4,4-trifluoro-3-trifluoromethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.