Ketobemidone
[CAS# 469-79-4]

Identification

• Name: Ketobemidone
• Synonyms: 1-[4-(3-Hydroxyphenyl)-1-Methyl-4-Piperidyl]Propan-1-One; 1-[4-(3-Hydroxyphenyl)-1-Methyl-4-Piperidinyl]Propan-1-One; 1-[4-(3-Hydroxyphenyl)-1-Methyl-Piperidin-4-Yl]Propan-1-One
• Molecular Formula: C₁₅H₂₁NO₂
• Molecular Weight: 247.34
• CAS Registry Number: 469-79-4
• EINECS: 207-421-0
• SMILES: C1=C(C=CC=C1C2(CCN(C)CC2)C(CC)=O)O
• InChI: 1S/C15H21NO2/c1-3-14(18)15(7-9-16(2)10-8-15)12-5-4-6-13(17)11-12/h4-6,11,17H,3,7-10H2,1-2H3
• InChIKey: ALFGKMXHOUSVAD-UHFFFAOYSA-N

Properties

• Density: 1.1±0.1g/cm³ (Cal.)
• Boiling point: 391.3±42.0°C at 760 mmHg (Cal.)
• Flash point: 190.4±27.9°C (Cal.)

Safety Data

• Controlled Substance: DEA Drug Code Number: 9628

References

• (1): Ingela Sundström, Joris Arts, Douglas Westerlund and Per E. Andrén. In vivo investigation of brain and systemic ketobemidone metabolism, Analyst, 2010, 135, 405.