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140682-23-1

140682-23-1 | 2-Propen-1-one, 1-phenyl-3-[2-(trifluoromethyl)phenyl]-, (2E)-

CAS No: 140682-23-1 Catalog No: AG001CPA MDL No:

Product Description

Catalog Number:
AG001CPA
Chemical Name:
2-Propen-1-one, 1-phenyl-3-[2-(trifluoromethyl)phenyl]-, (2E)-
CAS Number:
140682-23-1
Molecular Formula:
C16H11F3O
Molecular Weight:
276.2531
IUPAC Name:
1-phenyl-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-one
InChI:
InChI=1S/C16H11F3O/c17-16(18,19)14-9-5-4-6-12(14)10-11-15(20)13-7-2-1-3-8-13/h1-11H
InChI Key:
NUNGHCGIWAQKCC-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)/C=C/c1ccccc1C(F)(F)F

Properties

Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.076g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.258g/mol
Monoisotopic Mass:
276.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
4  

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