3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol

Base Information

• Chemical Name: 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol
• CAS No.: 7224-76-2
• Molecular Formula: C17H23 N O4
• Molecular Weight: 188.2441
• DSSTox Substance ID: DTXSID20992978

Synonyms:7224-76-2;3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol;DTXSID20992978

Chemical Property of 3-[(Methanesulfinyl)methyl]cyclohexa-3,5-diene-1,2-diol

Chemical Property:

• Vapor Pressure: 4.27E-09mmHg at 25°C
• Boiling Point: 427.4°Cat760mmHg
• Flash Point: 212.3°C
• Density: 1.425g/cm³
• XLogP3: -1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 188.05071541
• Heavy Atom Count: 12
• Complexity: 245

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• Canonical SMILES: CS(=O)CC1=CC=CC(C1O)O

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