N-1,2-Benzisothiazol-3-yl-4-nitrobenzamide

Base Information

• Chemical Name: N-1,2-Benzisothiazol-3-yl-4-nitrobenzamide
• CAS No.: 69504-35-4
• Molecular Formula: C14H9 N3 O3 S
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID50989457
• Wikidata: Q82978572
• Mol file: 69504-35-4.mol

Synonyms:69504-35-4;N-1,2-Benzisothiazol-3-yl-4-nitrobenzamide;Benzamide, N-1,2-benzisothiazol-3-yl-4-nitro-;DTXSID50989457;N-(1,2-Benzothiazol-3(2H)-ylidene)-4-nitrobenzamide

Chemical Property of N-1,2-Benzisothiazol-3-yl-4-nitrobenzamide

Chemical Property:

• Vapor Pressure: 1.17E-05mmHg at 25°C
• Boiling Point: 369.6°C at 760 mmHg
• Flash Point: 177.3°C
• PSA: 119.28000
• Density: 1.519g/cm³
• LogP: 3.40190
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 299.03646233
• Heavy Atom Count: 21
• Complexity: 407

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=NS2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]