4-(Sulfinylamino)benzonitrile

Base Information

• Chemical Name: 4-(Sulfinylamino)benzonitrile
• CAS No.: 52326-09-7
• Molecular Formula: C7H4N2OS
• Molecular Weight: 164.1845
• NSC Number: 202553
• DSSTox Substance ID: DTXSID20308151
• Wikidata: Q82055865
• Mol file: 52326-09-7.mol

Synonyms:52326-09-7;4-(sulfinylamino)benzonitrile;NSC202553;MIVBQKHQYGCXHL-UHFFFAOYSA-;DTXSID20308151;NSC-202553;InChI=1/C7H4N2OS/c8-5-6-1-3-7(4-2-6)9-11-10/h1-4H

Chemical Property of 4-(Sulfinylamino)benzonitrile

Chemical Property:

• Vapor Pressure: 0.00104mmHg at 25°C
• Boiling Point: 301.6°Cat760mmHg
• Flash Point: 136.2°C
• Density: 1.26g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 164.00443393
• Heavy Atom Count: 11
• Complexity: 218

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C#N)N=S=O