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36035-46-8 | N-(3-Fluorophenyl) bis-trifluoromethane sulfonimide
CAS No: 36035-46-8 Catalog No: AG01F8VV MDL No:
Product Description
Catalog Number:
AG01F8VV
Chemical Name:
N-(3-Fluorophenyl) bis-trifluoromethane sulfonimide
CAS Number:
36035-46-8
Molecular Formula:
C8H4F7NO4S2
Molecular Weight:
375.2405
IUPAC Name:
1,1,1-trifluoro-N-(3-fluorophenyl)-N-(trifluoromethylsulfonyl)methanesulfonamide
InChI:
InChI=1S/C8H4F7NO4S2/c9-5-2-1-3-6(4-5)16(21(17,18)7(10,11)12)22(19,20)8(13,14)15/h1-4H
InChI Key:
GEHNYRLFHODDAT-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)N(S(=O)(=O)C(F)(F)F)S(=O)(=O)C(F)(F)F
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.947g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.232g/mol
Monoisotopic Mass:
374.947g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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