Sodium 3-mercaptopropanesulphonate

Catalog Number	ACM17636101
CAS	17636-10-1
Structure
Synonyms	3-Mercapto-1-propanesulfonic acid sodium salt
IUPAC Name	Sodium;3-sulfanylpropane-1-sulfonate
Molecular Weight	178.2
Molecular Formula	C3H7NaO3S2
Canonical SMILES	C(CS)CS(=O)(=O)[O-].[Na+]
InChI	InChI=1S/C3H8O3S2.Na/c4-8(5,6)3-1-2-7;/h7H,1-3H2,(H,4,5,6);/q;+1/p-1
InChI Key	FRTIVUOKBXDGPD-UHFFFAOYSA-M
Melting Point	220 °C
Purity	98%+
Solubility	Soluble in water
Appearance	Powder
Storage	Inert atmosphere,room temperature
Exact Mass	177.97343071
Hydrogen-Bond Acceptor Count	4
Hydrogen-Bond Donor Count	1
Monoisotopic Mass	177.97343071
Rotatable-Bond Count	3
Topological Polar Surface Area	66.6 Ų

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