carbononitridic iodide

• ChemBase ID: 126777
• Molecular Formular: CIN
• Molecular Mass: 152.92187
• Monoisotopic Mass: 152.90754701
• SMILES: IC#N
• Canonical SMILES: IC#N
• InChI: InChI=1S/CIN/c2-1-3
• InChIKey: WPBXOELOQKLBDF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: carbononitridic iodide
• IUPAC Traditional name: cyanogen iodide
• Synonyms: Iodine cyanide; Cyanogen iodide

Database IDs

• CAS Number: 506-78-5
• EC Number: 208-053-3
• PubChem SID: 162221105
• PubChem CID: 10478
• Chemspider ID: 10046
• Wikipedia Title: Cyanogen_iodide

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.1099
• LogD (pH = 7.4): -0.1099
• Log P: -0.1099
• Molar Refractivity: 19.9964 cm^3
• Polarizability: 7.996237 Å^3
• Polar Surface Area: 23.79 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Reacts in water
• Apperance: White crystals
• Melting Point: 146.7°C
• Density: 1.84 g mL^-1
• Std enthalpy of formation: 160.5–169.1 kJ mol^-1

Safety Information

• RTECS: NN1750000
• NFPA704:
  

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