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Home > Fluorides > 1443353-95-4
1443353-95-4 | 2,6-Difluorophenyl cycloheptyl ketone
CAS No: 1443353-95-4 Catalog No: AG01FD7O MDL No:
Product Description
Catalog Number:
AG01FD7O
Chemical Name:
2,6-Difluorophenyl cycloheptyl ketone
CAS Number:
1443353-95-4
Molecular Formula:
C14H16F2O
Molecular Weight:
238.2730
IUPAC Name:
cycloheptyl-(2,6-difluorophenyl)methanone
InChI:
InChI=1S/C14H16F2O/c15-11-8-5-9-12(16)13(11)14(17)10-6-3-1-2-4-7-10/h5,8-10H,1-4,6-7H2
InChI Key:
RZDVEUYXZBFMTH-UHFFFAOYSA-N
SMILES:
O=C(c1c(F)cccc1F)C1CCCCCC1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.117g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.278g/mol
Monoisotopic Mass:
238.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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