n-[(2-Chloro-5-nitrophenyl)carbamothioyl]propanamide

Base Information

• Chemical Name: n-[(2-Chloro-5-nitrophenyl)carbamothioyl]propanamide
• CAS No.: 6599-87-7
• Molecular Formula: C10H10ClN3O3S
• Molecular Weight: 287.7227
• DSSTox Substance ID: DTXSID30358283
• Wikidata: Q82138745
• Mol file: 6599-87-7.mol

Synonyms:n-[(2-chloro-5-nitrophenyl)carbamothioyl]propanamide;6599-87-7;DTXSID30358283;AB00111655-01;SR-01000238356;SR-01000238356-1

Chemical Property of n-[(2-Chloro-5-nitrophenyl)carbamothioyl]propanamide

Chemical Property:

• Melting Point: 104 °C
• PSA: 129.57000
• Density: 1.489g/cm³
• LogP: 4.05520
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 287.0131401
• Heavy Atom Count: 18
• Complexity: 348

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(=O)NC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])Cl