tert-Butylbicyclophosphorothionate

Base Information

• Chemical Name: tert-Butylbicyclophosphorothionate
• CAS No.: 70636-86-1
• Molecular Formula: C8H15 O3 P S
• Molecular Weight: 222.24
• DSSTox Substance ID: DTXSID7058464
• Nikkaji Number: J107.117C
• Wikipedia: TBPS
• Wikidata: Q27088943
• ChEMBL ID: CHEMBL485673
• Mol file: 70636-86-1.mol

Synonyms:t-butylbicyclophosphorothionate;TBPS;tert-BBCP;tert-butylbicyclophosphorothionate

Chemical Property of tert-Butylbicyclophosphorothionate

Chemical Property:

• Vapor Pressure: 0.0952mmHg at 25°C
• Boiling Point: 231.3°C at 760 mmHg
• Flash Point: 93.7°C
• PSA: 69.59000
• Density: 1.25g/cm³
• LogP: 2.97100
• Storage Temp.: 2-8°C
• Solubility.: DMSO: soluble
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 222.04795251
• Heavy Atom Count: 13
• Complexity: 240

Purity/Quality:

97% ^*data from raw suppliers

tert-Butyl bicyclo[2.2.2]phosphorothionate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)(C)C12COP(=S)(OC1)OC2

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