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86156-93-6 | 3-Fluoro-4-nitrobenzene-1-sulfonyl chloride
CAS No: 86156-93-6 Catalog No: AG004KUN MDL No:MFCD03412240
Product Description
Catalog Number:
AG004KUN
Chemical Name:
3-Fluoro-4-nitrobenzene-1-sulfonyl chloride
CAS Number:
86156-93-6
Molecular Formula:
C6H3ClFNO4S
Molecular Weight:
239.6087
MDL Number:
MFCD03412240
IUPAC Name:
3-fluoro-4-nitrobenzenesulfonyl chloride
InChI:
InChI=1S/C6H3ClFNO4S/c7-14(12,13)4-1-2-6(9(10)11)5(8)3-4/h1-3H
InChI Key:
AAWFUSFNPBRQDE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1F)S(=O)(=O)Cl
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.946g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.601g/mol
Monoisotopic Mass:
238.946g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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