3,5-Dimethyl-4-[(E)-(3-nitrophenyl)diazenyl]-1H-pyrazole-1-carbothioamide

Base Information

• Chemical Name: 3,5-Dimethyl-4-[(E)-(3-nitrophenyl)diazenyl]-1H-pyrazole-1-carbothioamide
• CAS No.: 35872-20-9
• Molecular Formula: C12H12N6O2S
• Molecular Weight: 304.3277
• DSSTox Substance ID: DTXSID80404401
• NSC Number: 127100

Synonyms:35872-20-9;NSC127100;DTXSID80404401;3,5-Dimethyl-4-[(E)-(3-nitrophenyl)diazenyl]-1H-pyrazole-1-carbothioamide;NSC-127100

Chemical Property of 3,5-Dimethyl-4-[(E)-(3-nitrophenyl)diazenyl]-1H-pyrazole-1-carbothioamide

Chemical Property:

• Vapor Pressure: 3.88E-12mmHg at 25°C
• Boiling Point: 549.8°C at 760 mmHg
• Flash Point: 286.3°C
• Density: 1.5g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 304.07424482
• Heavy Atom Count: 21
• Complexity: 440

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=NN1C(=S)N)C)N=NC2=CC(=CC=C2)[N+](=O)[O-]

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