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61404-98-6 | sodium 4-iodobenzene-1-sulfinate
CAS No: 61404-98-6 Catalog No: AG01C85K MDL No:MFCD31440822
Product Description
Catalog Number:
AG01C85K
Chemical Name:
sodium 4-iodobenzene-1-sulfinate
CAS Number:
61404-98-6
Molecular Formula:
C6H4INaO2S
Molecular Weight:
290.0540
MDL Number:
MFCD31440822
IUPAC Name:
sodium;4-iodobenzenesulfinate
InChI:
InChI=1S/C6H5IO2S.Na/c7-5-1-3-6(4-2-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1
InChI Key:
IILVFSMKWWTVRT-UHFFFAOYSA-M
SMILES:
Ic1ccc(cc1)S(=O)[O-].[Na+]
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.887g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.05g/mol
Monoisotopic Mass:
289.887g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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