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Sodium methanethiosulfonate

CAT: 0127-OR938724-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR938724-01Size:1 g
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CAS Number
1950-85-2
MDL Number
MFCD03425630
Purity
97%
Smiles
CS(=O)(=O)S[Na]

Chemical Information

Methanesulfonothioic acid, sodium salt (1:1)
CAS Number1950-85-2
PubChem CID23688755
IUPAC Namesodium methyl-oxido-oxo-sulfanylidene-lambda6-sulfane
Molecular FormulaCH3NaO2S2
Molecular Weight134.16
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count6
Formal Charge0
Complexity113
SMILES
CS(=O)(=S)[O-].[Na+]
InChI
InChI=1S/CH4O2S2.Na/c1-5(2,3)4;/h1H3,(H,2,3,4);/q;+1/p-1
InChIKey
JFTZUZWJGUCSTE-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Methanesulfonothioic acid, sodium salt (1:1)
CAS: 1950-85-2
CID: 23688755
Formula: CH3NaO2S2
MW: 134.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight134.16
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass133.94721596
Monoisotopic Mass133.94721596
Topological Polar Surface Area80.6 Ų
Heavy Atom Count6
Formal Charge0
Complexity113
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-S645000-10GSodium Methanethiosulfonate
sc-212934Sodium (3-Sulfonatopropyl) methanethiosulfonate
sc-212936Sodium (5-Sulfonatopentyl) methanethiosulfonate
sc-212933Sodium (2-Sulfonatoethyl) methanethiosulfonate
TRC-S671000-1GSodium (4-Sulfonatobutyl)methanethiosulfonate
MBS6100248-01Sodium Methanethiosulfonate (Na-MTS)
TRC-S672000-50MGSodium (2-Sulfonatoethyl)methanethiosulfonate
sc-212935Sodium (4-Sulfonatobutyl) methanethiosulfonate
S5326-45ASodium (2-Sulfonatoethyl) methanethiosulfonate (MTSES)
MBS6093081-01Sodium (2-Sulfonatoethyl)methanethiosulfonate (MTSES)

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