Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate

Base Information

• Chemical Name: Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate
• CAS No.: 49625-94-7
• Molecular Formula: C10H10NNaO3S3
• Molecular Weight: 311.38
• European Community (EC) Number: 256-401-8
• DSSTox Substance ID: DTXSID7068500
• Nikkaji Number: J52.318F
• Mol file: 49625-94-7.mol

Synonyms:49625-94-7;Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate;Sodium 3-(benzo[d]thiazol-2-ylthio)propane-1-sulfonate;1-Propanesulfonic acid, 3-(2-benzothiazolylthio)-, sodium salt;sodium;3-(1,3-benzothiazol-2-ylsulfanyl)propane-1-sulfonate;3-(2-benzthiazolylthio)-1-propanesulfonic acid sodium salt;Sodium 3-(benzothiazol-2-ylthio)propanesulphonate;EINECS 256-401-8;sodium 3-(1,3-benzothiazol-2-ylsulfanyl)propane-1-sulfonate;C10H10NNaO3S3;SCHEMBL565101;DTXSID7068500;1-Propanesulfonic acid, 3-(2-benzothiazolylthio)-, sodium salt (1:1);MFCD00043131;AKOS015912782;CS-W012057;AC-32133;AS-69544;FT-0639873;NS00057430;D84143;A827777;W-106018;Sodium3-(benzo[d]thiazol-2-ylthio)propane-1-sulfonate;2-[4-(tert-Butyldimethylsilyloxymethyl)-2-nitrophenoxy]aceticAcid;ZPS(3-(+/-(1/2)(2) centacsso-2-UI>>u)-+/-uIe>>CAAE);Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate, technical, >=90% (NT)

Chemical Property of Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate

Chemical Property:

• Appearance/Colour: Light yellow crystal
• Melting Point: ≥320 °C (dec.)
• Flash Point: 110 °C
• PSA: 132.01000
• Density: 1.593-1.597g/cm3 at 22℃
• LogP: 3.40450
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 310.97205098
• Heavy Atom Count: 18
• Complexity: 347

Purity/Quality:

99% ^*data from raw suppliers

Sodium3-(benzo[d]thiazol-2-ylthio)propane-1-sulfonate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)SCCCS(=O)(=O)[O-].[Na+]
• Uses: Sodium 3-(benzothiazol-2-ylthio)-1-propanesulfonate may be used in the chemical synthesis studies.

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