Synonyms
sodium oxane-4-sulfinate;1516140-99-0;Sodium tetrahydropyransulfinate;Tetrahydro-2H-pyran-4-sulfinic acid sodium salt;
IUPAC Name
sodium;oxane-4-sulfinate;
Molecular Weight
172.174g/mol
Molecular Formula
C5H9NaO3S;
Canonical SMILES
C1COCCC1S(=O)[O-].[Na+];
InChI
InChI=1S/C5H10O3S.Na/c6-9(7)5-1-3-8-4-2-5;/h5H,1-4H2,(H,6,7);/q;+1/p-1;
InChI Key
JIOKFXIXTDFEIS-UHFFFAOYSA-M;
Complexity
114
Covalently-Bonded Unit Count
2
Exact Mass
172.017g/mol
H-Bond Acceptor
4
Heavy Atom Count
10
Monoisotopic Mass
172.017g/mol
Rotatable Bond Count
1
Topological Polar Surface Area
68.6A^2
