goldcarbonitrile

• ChemBase ID: 135491
• Molecular Formular: CAuN
• Molecular Mass: 222.98395
• Monoisotopic Mass: 222.96964201
• SMILES: C(#N)[Au]
• Canonical SMILES: [Au]C#N
• InChI: InChI=1S/CN.Au/c1-2
• InChIKey: DRJJJWGHLJZDGQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: goldcarbonitrile
• IUPAC Traditional name: goldcarbonitrile
• Synonyms: Gold(I) cyanide; 氰化亚金

Database IDs

• CAS Number: 506-65-0
• EC Number: 208-049-1
• MDL Number: MFCD00003437
• PubChem SID: 24855354; 162229765
• PubChem CID: 68172

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.0799
• LogD (pH = 7.4): -0.0799
• Log P: -0.0799
• Molar Refractivity: 6.6556 cm^3
• Polarizability: 9.928846 Å^3
• Polar Surface Area: 23.79 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Density: 7.14 g/mL at 25 °C(lit.)

Safety Information

• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: 1588
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 26/27/28-32-50/53
• Safety Statements: 7-28-29-45-60-61
• GHS Pictograms: GHS06; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H300-H310-H330-H410
• GHS Precautionary statements: P260-P264-P273-P280-P284-P301 + P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 1588 6.1/PG 2
• Supplemental Hazard Statements: Contact with acids liberates very toxic gas.

Product Information

• Purity: 99.9% trace metals basis
• Linear Formula: AuCN

DETAILS

Sigma Aldrich - 254088

Packaging
1 g in glass bottle