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Home > Fluorides > 1443335-76-9
1443335-76-9 | 4-Fluoro-3-(trifluoromethyl)phenyl cyclohexyl ketone
CAS No: 1443335-76-9 Catalog No: AG01F8K6 MDL No:
Product Description
Catalog Number:
AG01F8K6
Chemical Name:
4-Fluoro-3-(trifluoromethyl)phenyl cyclohexyl ketone
CAS Number:
1443335-76-9
Molecular Formula:
C14H14F4O
Molecular Weight:
274.2540
IUPAC Name:
cyclohexyl-[4-fluoro-3-(trifluoromethyl)phenyl]methanone
InChI:
InChI=1S/C14H14F4O/c15-12-7-6-10(8-11(12)14(16,17)18)13(19)9-4-2-1-3-5-9/h6-9H,1-5H2
InChI Key:
BYIPTVIPKUCICM-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)C(F)(F)F)F)C1CCCCC1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.098g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.259g/mol
Monoisotopic Mass:
274.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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