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921932-46-9

921932-46-9 | 2-Buten-1-one, 4,4,4-trifluoro-2-(1-naphthalenyl)-1-phenyl-, (2Z)-

CAS No: 921932-46-9 Catalog No: AG006FX1 MDL No:

Product Description

Catalog Number:
AG006FX1
Chemical Name:
2-Buten-1-one, 4,4,4-trifluoro-2-(1-naphthalenyl)-1-phenyl-, (2Z)-
CAS Number:
921932-46-9
Molecular Formula:
C20H13F3O
Molecular Weight:
326.3118
IUPAC Name:
4,4,4-trifluoro-2-naphthalen-1-yl-1-phenylbut-2-en-1-one
InChI:
InChI=1S/C20H13F3O/c21-20(22,23)13-18(19(24)15-8-2-1-3-9-15)17-12-6-10-14-7-4-5-11-16(14)17/h1-13H
InChI Key:
DVUUPCBIBJFMSD-UHFFFAOYSA-N
SMILES:
O=C(/C(=C\C(F)(F)F)/c1cccc2c1cccc2)c1ccccc1

Properties

Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.092g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
326.318g/mol
Monoisotopic Mass:
326.092g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
5.8  

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