(potassiosulfanyl)({tricyclo[5.2.1.0^{2,6}]decan-8-yloxy})methanethione

• ChemBase ID: 105993
• Molecular Formular: C11H15KOS2
• Molecular Mass: 266.4645
• Monoisotopic Mass: 266.02013878
• SMILES: [K]SC(=S)OC1CC2CC1C1CCCC21
• Canonical SMILES: [K]SC(=S)OC1CC2CC1C1C2CCC1
• InChI: InChI=1S/C11H16OS2.K/c13-11(14)12-10-5-6-4-9(10)8-3-1-2-7(6)8;/h6-10H,1-5H2,(H,13,14);/q;+1/p-1
• InChIKey: IGULCCCBGBDZKQ-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: (potassiosulfanyl)({tricyclo[5.2.1.0^{2,6}]decan-8-yloxy})methanethione
• IUPAC Traditional name: (potassiosulfanyl)({tricyclo[5.2.1.0^{2,6}]decan-8-yloxy})methanethione
• Synonyms: D609; TRICYCLODECAN-9-YL XANTHOGENATE POTASSIUM SALT

Database IDs

• CAS Number: 83373-60-8
• EC Number: 280-379-9
• PubChem SID: 162092878
• PubChem CID: 4234241

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 2.1175
• LogD (pH = 7.4): 2.1175
• Log P: 2.1175
• Molar Refractivity: 63.301098 cm^3
• Polarizability: 28.196167 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Condition: -20°C

Product Information

• Purity: 98%

DETAILS

MP Biomedicals - 02195683

Purity: 98%
Potassium Salt
A selective inhibitor of phosphatidylcholine-specific PLC. Possesses antitumor and antiviral activity.