4-Methylthiobenzamide-S-oxide

Base Information

• Chemical Name: 4-Methylthiobenzamide-S-oxide
• CAS No.: 75554-00-6
• Molecular Formula: C8H9 N O S
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID00997007
• Wikidata: Q82988950
• Mol file: 75554-00-6.mol

Synonyms:4-methylthiobenzamide-S-oxide;4-PMTBSO

Chemical Property of 4-Methylthiobenzamide-S-oxide

Chemical Property:

• Vapor Pressure: 0.00319mmHg at 25°C
• Boiling Point: 283.3°C at 760 mmHg
• Flash Point: 125.1°C
• PSA: 75.18000
• Density: 1.19g/cm³
• LogP: 2.21070
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 167.04048508
• Heavy Atom Count: 11
• Complexity: 179

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=S=O)N