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Home > Fluorides > 949084-33-7
949084-33-7 | 4'-(4-Fluorophenyl)-2,2,2-trifluoroacetophenone
CAS No: 949084-33-7 Catalog No: AG01EZKY MDL No:
Product Description
Catalog Number:
AG01EZKY
Chemical Name:
4'-(4-Fluorophenyl)-2,2,2-trifluoroacetophenone
CAS Number:
949084-33-7
Molecular Formula:
C14H8F4O
Molecular Weight:
268.2063
IUPAC Name:
2,2,2-trifluoro-1-[4-(4-fluorophenyl)phenyl]ethanone
InChI:
InChI=1S/C14H8F4O/c15-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(19)14(16,17)18/h1-8H
InChI Key:
JIOAQAPBLPSVNH-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1ccc(cc1)C(=O)C(F)(F)F
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.051g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.211g/mol
Monoisotopic Mass:
268.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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