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825-86-5 | Benzenesulfonamide,4-iodo-
CAS No: 825-86-5 Catalog No: AG0052WY MDL No:MFCD00092887
Product Description
Catalog Number:
AG0052WY
Chemical Name:
Benzenesulfonamide,4-iodo-
CAS Number:
825-86-5
Molecular Formula:
C6H6INO2S
Molecular Weight:
283.0868
MDL Number:
MFCD00092887
IUPAC Name:
4-iodobenzenesulfonamide
InChI:
InChI=1S/C6H6INO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10)
InChI Key:
KQZFABSTXSNEQH-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)S(=O)(=O)N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.916g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.083g/mol
Monoisotopic Mass:
282.916g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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