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sodium oxane-4-sulfinate

sodium oxane-4-sulfinate

CAS: 1516140-99-0

Formula: C5H9NaO3S

SMILES: [Na+].[O-]S(=O)C1CCOCC1

IUPAC: sodium oxane-4-sulfinate

InChI: InChI=1/C5H10O3S.Na/c6-9(7)5-1-3-8-4-2-5;/h5H,1-4H2,(H,6,7);/q;+1/p-1

Composition: C (34.88%), H (5.27%), Na (13.35%), O (27.88%), S (18.62%)

Molar Mass: 172.17

Atom Count: 19

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 172.0170096
Formal Charge 0
FSP3 1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey JIOKFXIXTDFEIS-UHFFFAOYNA-M
Lipinski's Rule of Five 1
Molar Refractivity 32.9
Topological Polar Surface Area 49.36
Polarizability 13.94
Ring Count 1
Rotatable Bond Count 1

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