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Home > Fluorides > 1027345-08-9
1027345-08-9 | Benzenesulfonamide, 4-fluoro-3-[(trifluoromethyl)sulfonyl]-
CAS No: 1027345-08-9 Catalog No: AG00088P MDL No:MFCD16251392
Product Description
Catalog Number:
AG00088P
Chemical Name:
Benzenesulfonamide, 4-fluoro-3-[(trifluoromethyl)sulfonyl]-
CAS Number:
1027345-08-9
Molecular Formula:
C7H5F4NO4S2
Molecular Weight:
307.2425
MDL Number:
MFCD16251392
IUPAC Name:
4-fluoro-3-(trifluoromethylsulfonyl)benzenesulfonamide
InChI:
InChI=1S/C7H5F4NO4S2/c8-5-2-1-4(18(12,15)16)3-6(5)17(13,14)7(9,10)11/h1-3H,(H2,12,15,16)
InChI Key:
JOESWBMGEGYULU-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1S(=O)(=O)C(F)(F)F)S(=O)(=O)N
Properties
Complexity:
501
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.96g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
307.234g/mol
Monoisotopic Mass:
306.96g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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