pentasulfane-1,5-diide

• ChemBase ID: 2665
• Molecular Formular: S5--
• Molecular Mass: 160.325
• Monoisotopic Mass: 159.860355
• SMILES: [S-]SSS[S-]
• Canonical SMILES: [S-]SSS[S-]
• InChI: InChI=1S/H2S5/c1-3-5-4-2/h1-2H/p-2
• InChIKey: FBNHIFPJXGPDIP-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: pentasulfane-1,5-diide
• IUPAC Traditional name: pentasulfide-sulfur
• Synonyms: Pentasulfide-Sulfur

Database IDs

• PubChem SID: 160966114; 46508164
• PubChem CID: 5289210

CALCULATED PROPERTIES

• Acid pKa: 8.820068
• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.8269534
• LogD (pH = 7.4): 2.8114026
• Log P: 2.8271554
• Molar Refractivity: 36.135 cm^3
• Polarizability: 16.60516 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

DETAILS

DrugBank - DB02956

Drug information: experimental