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Home > Fluorides > 142272-54-6
142272-54-6 | Cyclohexanone, 2,6-bis(4-fluorophenyl)-
CAS No: 142272-54-6 Catalog No: AG001I3W MDL No:
Product Description
Catalog Number:
AG001I3W
Chemical Name:
Cyclohexanone, 2,6-bis(4-fluorophenyl)-
CAS Number:
142272-54-6
Molecular Formula:
C18H16F2O
Molecular Weight:
286.3158
IUPAC Name:
2,6-bis(4-fluorophenyl)cyclohexan-1-one
InChI:
InChI=1S/C18H16F2O/c19-14-8-4-12(5-9-14)16-2-1-3-17(18(16)21)13-6-10-15(20)11-7-13/h4-11,16-17H,1-3H2
InChI Key:
RRGPXVUIDPCSSJ-UHFFFAOYSA-N
SMILES:
O=C1C(CCCC1c1ccc(cc1)F)c1ccc(cc1)F
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.117g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.322g/mol
Monoisotopic Mass:
286.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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