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Home > Fluorides > 121456-63-1
121456-63-1 | Ethanone, 1-(2,6-dimethylphenyl)-2,2,2-trifluoro-
CAS No: 121456-63-1 Catalog No: AG0014ZZ MDL No:MFCD01319986
Product Description
Catalog Number:
AG0014ZZ
Chemical Name:
Ethanone, 1-(2,6-dimethylphenyl)-2,2,2-trifluoro-
CAS Number:
121456-63-1
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
MDL Number:
MFCD01319986
IUPAC Name:
1-(2,6-dimethylphenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C10H9F3O/c1-6-4-3-5-7(2)8(6)9(14)10(11,12)13/h3-5H,1-2H3
InChI Key:
ZCXOVQMIBTWGCB-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1c(C)cccc1C
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.176g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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