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Home > Fluorides > 1443346-34-6
1443346-34-6 | 2,4,5-Trifluorophenyl cyclohexyl ketone
CAS No: 1443346-34-6 Catalog No: AG01FCEU MDL No:
Product Description
Catalog Number:
AG01FCEU
Chemical Name:
2,4,5-Trifluorophenyl cyclohexyl ketone
CAS Number:
1443346-34-6
Molecular Formula:
C13H13F3O
Molecular Weight:
242.2369
IUPAC Name:
cyclohexyl-(2,4,5-trifluorophenyl)methanone
InChI:
InChI=1S/C13H13F3O/c14-10-7-12(16)11(15)6-9(10)13(17)8-4-2-1-3-5-8/h6-8H,1-5H2
InChI Key:
CGUJBOWHWVKQLE-UHFFFAOYSA-N
SMILES:
O=C(c1cc(F)c(cc1F)F)C1CCCCC1
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.092g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.241g/mol
Monoisotopic Mass:
242.092g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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