sulfanylidene

• ChemBase ID: 158796
• Molecular Formular: S
• Molecular Mass: 32.065
• Monoisotopic Mass: 31.972071
• SMILES: [S]
• Canonical SMILES: [S]
• InChI: InChI=1S/S
• InChIKey: NINIDFKCEFEMDL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: sulfanylidene
• IUPAC Traditional name: sulfanylidene
• Synonyms: Sulfur; 硫

Database IDs

• CAS Number: 7704-34-9
• MDL Number: MFCD00085316
• PubChem SID: 162252931
• PubChem CID: 402

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 0.6145
• LogD (pH = 7.4): 0.6145
• Log P: 0.6145
• Molar Refractivity: 5.7558 cm^3
• Polarizability: 3.055504 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 112.8 °C (rhombic)(lit.); 117-120 °C(lit.); 119.0 °C (monoclinic)(lit.)
• Boiling Point: 444.7 °C(lit.)
• Auto Ignition Point: 450 °F
• Vapor Pressure: 1 mmHg ( 183.8 °C); 10 mmHg ( 246 °C)
• Vapor Density: 8.9 (vs air)
• Resistivity: 2E23 μΩ-cm20°C

Product Information

• Purity: ≥98.0%
• Grade: SAJ first grade
• Empirical Formula (Hill Notation): S