9-Chloro-1,4,5,8-tetrahydro-4a,8a-(methanothiomethano)naphthalene 10,10-dioxide

Base Information

• Chemical Name: 9-Chloro-1,4,5,8-tetrahydro-4a,8a-(methanothiomethano)naphthalene 10,10-dioxide
• CAS No.: 33800-84-9
• Molecular Formula: C12H15ClO2S
• Molecular Weight: 258.76
• NSC Number: 135305
• DSSTox Substance ID: DTXSID30300186

Synonyms:33800-84-9;NSC135305;9-chloro-1,4,5,8-tetrahydro-4a,8a-(methanothiomethano)naphthalene 10,10-dioxide;DTXSID30300186;RCL T169595;RCL T182435;AKOS024321443;NSC-135305

Chemical Property of 9-Chloro-1,4,5,8-tetrahydro-4a,8a-(methanothiomethano)naphthalene 10,10-dioxide

Chemical Property:

• Vapor Pressure: 4.45E-08mmHg at 25°C
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 258.0481286
• Heavy Atom Count: 16
• Complexity: 452

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1C=CCC23C1(CC=CC2)CS(=O)(=O)C3Cl

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