cadmium(2+) ion bis(iminomethanide)

• ChemBase ID: 110624
• Molecular Formular: C2CdN2
• Molecular Mass: 164.4458
• Monoisotopic Mass: 165.90950601
• SMILES: [Cd+2].[C-]#N.[C-]#N
• Canonical SMILES: N#[C-].N#[C-].[Cd+2]
• InChI: InChI=1S/2CN.Cd/c2*1-2;/q2*-1;+2
• InChIKey: NHMJUOSYSOOPDM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: cadmium(2+) ion bis(iminomethanide)
• IUPAC Traditional name: cadmium(2+) bis(cyanide); cadmium(2+) ion bis(cyanide)
• Synonyms: CADMIUM CYANIDE

Database IDs

• CAS Number: 542-83-6
• EC Number: 208-829-1
• PubChem SID: 162095997
• PubChem CID: 68335
• Chemspider ID: 61630
• Wikipedia Title: Cadmium_cyanide

CALCULATED PROPERTIES

• Acid pKa: 9.5
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.34610683
• LogD (pH = 7.4): -0.33904728
• Log P: -0.34619832
• Molar Refractivity: 15.8149 cm^3
• Polarizability: 2.6105857 Å^3
• Polar Surface Area: 23.79 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: 1.71 g/100 mL (15 °C) ; 2.2 g/100 mL (20 °C) in water; slightly soluble in alcohol ; dissolves in alkali, metal cyanides and hydroxides
• Apperance: white cubic crystals
• Density: 2.226 g/cm^3

Safety Information

• RTECS: EV0280000
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• Risk Statements: R:26/27/28-32-33-40-50/53
• Safety Statements: S:7-28-29-45-60-61

DETAILS

MP Biomedicals - 05215745

MP Biomedicals Rare Chemical collection