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Home > Fluorides > 921932-49-2
921932-49-2 | 1-Butanone, 4,4,4-trifluoro-3-(4-methylphenyl)-1-phenyl-
CAS No: 921932-49-2 Catalog No: AG006FU4 MDL No:
Product Description
Catalog Number:
AG006FU4
Chemical Name:
1-Butanone, 4,4,4-trifluoro-3-(4-methylphenyl)-1-phenyl-
CAS Number:
921932-49-2
Molecular Formula:
C17H15F3O
Molecular Weight:
292.2956
IUPAC Name:
4,4,4-trifluoro-3-(4-methylphenyl)-1-phenylbutan-1-one
InChI:
InChI=1S/C17H15F3O/c1-12-7-9-13(10-8-12)15(17(18,19)20)11-16(21)14-5-3-2-4-6-14/h2-10,15H,11H2,1H3
InChI Key:
NDZCGIOJQVHVGT-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(C(F)(F)F)CC(=O)c1ccccc1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.107g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.301g/mol
Monoisotopic Mass:
292.107g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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