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2098851-46-6 | sodium 4,6-dimethylpyridine-2-sulfinate
CAS No: 2098851-46-6 Catalog No: AG01EIKQ MDL No:
Product Description
Catalog Number:
AG01EIKQ
Chemical Name:
sodium 4,6-dimethylpyridine-2-sulfinate
CAS Number:
2098851-46-6
Molecular Formula:
C7H8NNaO2S
Molecular Weight:
193.1987
IUPAC Name:
sodium;4,6-dimethylpyridine-2-sulfinate
InChI:
InChI=1S/C7H9NO2S.Na/c1-5-3-6(2)8-7(4-5)11(9)10;/h3-4H,1-2H3,(H,9,10);/q;+1/p-1
InChI Key:
KQXCNQUPLKHKSF-UHFFFAOYSA-M
SMILES:
Cc1cc(C)nc(c1)S(=O)[O-].[Na+]
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.017g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.196g/mol
Monoisotopic Mass:
193.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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