3-tert-Butyldiphenylsiloxy-2,3,3a,7a-tetrahydrobenzo(b)thiophen-5(4H)-one 1,1-dioxide

Base Information

• Chemical Name: 3-tert-Butyldiphenylsiloxy-2,3,3a,7a-tetrahydrobenzo(b)thiophen-5(4H)-one 1,1-dioxide
• CAS No.: 127486-99-1
• Molecular Formula: C24H28 O4 S Si
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID60155585
• Wikidata: Q83023518
• Mol file: 127486-99-1.mol

Synonyms:3-BSTBTD;3-tert-butyldiphenylsiloxy-2,3,3a,7a-tetrahydrobenzo(b)thiophen-5(4H)-one 1,1-dioxide

Chemical Property of 3-tert-Butyldiphenylsiloxy-2,3,3a,7a-tetrahydrobenzo(b)thiophen-5(4H)-one 1,1-dioxide

Chemical Property:

• Vapor Pressure: 3.92E-13mmHg at 25°C
• Boiling Point: 572.9°Cat760mmHg
• Flash Point: 300.3°C
• PSA: 68.82000
• Density: 1.21g/cm³
• LogP: 3.95460
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 440.14775708
• Heavy Atom Count: 30
• Complexity: 746

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OC3CS(=O)(=O)C4C3CC(=O)C=C4
• Isomeric SMILES: CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)O[C@H]3CS(=O)(=O)[C@H]4[C@@H]3CC(=O)C=C4

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