1,4-Dimethyl-9H-indeno(1,2-d)(1,2)oxathiin-9-one 3,3-dioxide

Base Information

• Chemical Name: 1,4-Dimethyl-9H-indeno(1,2-d)(1,2)oxathiin-9-one 3,3-dioxide
• CAS No.: 55039-39-9
• Molecular Formula: C13H10O4S
• Molecular Weight: 262.2811
• NSC Number: 166739
• DSSTox Substance ID: DTXSID90203583
• Wikidata: Q83076987
• ChEMBL ID: CHEMBL1996320

Synonyms:55039-39-9;NSC166739;NSC 166739;1,4-Dimethyl-9H-indeno(1,2-d)(1,2)oxathiin-9-one 3,3-dioxide;1,4-Dimethyl-9H-indeno[1,2-d][1,2]oxathiin-9-one 3,3-dioxide;CHEMBL1996320;DTXSID90203583;NSC-166739;NCI60_001316;1,4-dimethyl-3,3-dioxo-indeno[1,2-d]oxathiin-9-one;9H-Indeno[1,2]oxathiin-9-one, 1,4-dimethyl-, 3,3-dioxide;{9H-Indeno[1,2-d][1,2]oxathiin-9-one,} 1,4-dimethyl-, 3,3-dioxide

Chemical Property of 1,4-Dimethyl-9H-indeno(1,2-d)(1,2)oxathiin-9-one 3,3-dioxide

Chemical Property:

• Vapor Pressure: 5.34E-08mmHg at 25°C
• Boiling Point: 441.7°C at 760 mmHg
• Flash Point: 220.9°C
• Density: 1.48g/cm³
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 262.02997997
• Heavy Atom Count: 18
• Complexity: 589

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2C(=C(S(=O)(=O)O1)C)C3=CC=CC=C3C2=O

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