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Home > Fluorides > 1365271-68-6
1365271-68-6 | 1-Hexanone, 1-[4-(trifluoromethoxy)phenyl]-
CAS No: 1365271-68-6 Catalog No: AG0011Z2 MDL No:MFCD21609708
Product Description
Catalog Number:
AG0011Z2
Chemical Name:
1-Hexanone, 1-[4-(trifluoromethoxy)phenyl]-
CAS Number:
1365271-68-6
Molecular Formula:
C13H15F3O2
Molecular Weight:
260.2522
MDL Number:
MFCD21609708
IUPAC Name:
1-[4-(trifluoromethoxy)phenyl]hexan-1-one
InChI:
InChI=1S/C13H15F3O2/c1-2-3-4-5-12(17)10-6-8-11(9-7-10)18-13(14,15)16/h6-9H,2-5H2,1H3
InChI Key:
ZNKDCLXIWZAKRU-UHFFFAOYSA-N
SMILES:
CCCCCC(=O)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.102g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.256g/mol
Monoisotopic Mass:
260.102g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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