Butyl carbamimidothioate;2,4,6-trinitrophenol

Base Information

• Chemical Name: Butyl carbamimidothioate;2,4,6-trinitrophenol
• CAS No.: 2788-59-2
• Molecular Formula: C11H15N5O7S
• Molecular Weight: 361.3311
• NSC Number: 404791
• DSSTox Substance ID: DTXSID90323755
• Mol file: 2788-59-2.mol

Synonyms:2788-59-2;NSC 404791;NSC404791;DTXSID90323755;NSC-404791;Butyl carbamimidothioate--2,4,6-trinitrophenol (1/1)

Chemical Property of Butyl carbamimidothioate;2,4,6-trinitrophenol

Chemical Property:

• Vapor Pressure: 0.000514mmHg at 25°C
• Boiling Point: 303.6°Cat760mmHg
• Flash Point: 133.9°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 4
• Exact Mass: 361.06921901
• Heavy Atom Count: 24
• Complexity: 364

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSC(=N)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

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