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Home > Fluorides > 1443329-43-8
1443329-43-8 | 3,5-Bis(trifluoromethyl)phenyl cyclopentyl ketone
CAS No: 1443329-43-8 Catalog No: AG01F9BH MDL No:
Product Description
Catalog Number:
AG01F9BH
Chemical Name:
3,5-Bis(trifluoromethyl)phenyl cyclopentyl ketone
CAS Number:
1443329-43-8
Molecular Formula:
C14H12F6O
Molecular Weight:
310.2349
IUPAC Name:
[3,5-bis(trifluoromethyl)phenyl]-cyclopentylmethanone
InChI:
InChI=1S/C14H12F6O/c15-13(16,17)10-5-9(6-11(7-10)14(18,19)20)12(21)8-3-1-2-4-8/h5-8H,1-4H2
InChI Key:
PMEKSRJQUHQGJS-UHFFFAOYSA-N
SMILES:
O=C(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C1CCCC1
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
310.239g/mol
Monoisotopic Mass:
310.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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