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Home > Fluorides > 1356090-88-4
1356090-88-4 | 2-Methyl-N-[(1E)-1-(2,4,6-trifluorophenyl)ethylidene]propane-2-sulfinamide
CAS No: 1356090-88-4 Catalog No: AG01F4IW MDL No:
Product Description
Catalog Number:
AG01F4IW
Chemical Name:
2-Methyl-N-[(1E)-1-(2,4,6-trifluorophenyl)ethylidene]propane-2-sulfinamide
CAS Number:
1356090-88-4
Molecular Formula:
C12H14F3NOS
Molecular Weight:
277.3059
IUPAC Name:
(NE,S)-2-methyl-N-[1-(2,4,6-trifluorophenyl)ethylidene]propane-2-sulfinamide
InChI:
InChI=1S/C12H14F3NOS/c1-7(16-18(17)12(2,3)4)11-9(14)5-8(13)6-10(11)15/h5-6H,1-4H3/b16-7+/t18-/m0/s1
InChI Key:
ADGUPYIHLFACOC-ULUBDBHXSA-N
SMILES:
C/C(=N\[S@@](=O)C(C)(C)C)/c1c(F)cc(cc1F)F
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
1
Exact Mass:
277.075g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.305g/mol
Monoisotopic Mass:
277.075g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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