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Home > Fluorides > 256935-94-1
256935-94-1 | 3-Fluoro-4-nitrophenyl triflate
CAS No: 256935-94-1 Catalog No: AG01FEYB MDL No:MFCD18379767
Product Description
Catalog Number:
AG01FEYB
Chemical Name:
3-Fluoro-4-nitrophenyl triflate
CAS Number:
256935-94-1
Molecular Formula:
C7H3F4NO5S
Molecular Weight:
289.1610
MDL Number:
MFCD18379767
IUPAC Name:
(3-fluoro-4-nitrophenyl) trifluoromethanesulfonate
InChI:
InChI=1S/C7H3F4NO5S/c8-5-3-4(1-2-6(5)12(13)14)17-18(15,16)7(9,10)11/h1-3H
InChI Key:
ANXRHNZOWKWYFI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1F)OS(=O)(=O)C(F)(F)F
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.967g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.157g/mol
Monoisotopic Mass:
288.967g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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