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402-46-0 | 4-Fluorobenzenesulfonamide
CAS No: 402-46-0 Catalog No: AG00341A MDL No:MFCD00025384
Product Description
Catalog Number:
AG00341A
Chemical Name:
4-Fluorobenzenesulfonamide
CAS Number:
402-46-0
Molecular Formula:
C6H6FNO2S
Molecular Weight:
175.1807
MDL Number:
MFCD00025384
IUPAC Name:
4-fluorobenzenesulfonamide
InChI:
InChI=1S/C6H6FNO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10)
InChI Key:
LFLSATHZMYYIAQ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)S(=O)(=O)N
EC Number:
206-946-2
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.01g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.177g/mol
Monoisotopic Mass:
175.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| 2-Chloro-benzene-sulfonamide. | Acta crystallographica. Section E, Structure reports online 20090901 |
| o-Toluene-sulfonamide: a redetermination. | Acta crystallographica. Section E, Structure reports online 20090901 |
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