ChemSpider 2D Image | 1-[1-(1-Benzothiophen-2-yl)cyclohexyl]piperidinium | C19H26NS

1-[1-(1-Benzothiophen-2-yl)cyclohexyl]piperidinium

  • Molecular FormulaC19H26NS
  • Average mass300.481 Da
  • Monoisotopic mass300.178040 Da
  • ChemSpider ID27471388

  • Charge - Charge

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1-[1-(1-Benzothiophen-2-yl)cyclohexyl]piperidinium [German] [ACD/IUPAC Name]
1-[1-(1-Benzothiophen-2-yl)cyclohexyl]piperidinium [ACD/IUPAC Name]
1-[1-(1-Benzothiophén-2-yl)cyclohexyl]pipéridinium [French] [ACD/IUPAC Name]
1-[1-(1-benzothiophen-2-yl)cyclohexyl]piperidinium(1+)
Piperidine, 1-(1-benzo[b]thien-2-ylcyclohexyl)-, conjugate acid [ACD/Index Name]
benocyclidine cation
benocyclidine(1+)
BTCP cation
BTCP(1+)

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CHEBI:64146 [DBID]
  • Miscellaneous

    • Chemical Class:

      An organic cation that is the conjugate acid of 1-[1-(1-benzothiophen-2-yl)cyclohexyl]piperidine, arising from protonation of the tertiary amino function. ChEBI CHEBI:64146

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point: 425.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 211.1±21.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.05
ACD/LogD (pH 5.5): 3.31
ACD/BCF (pH 5.5): 41.51
ACD/KOC (pH 5.5): 81.24
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 1629.69
ACD/KOC (pH 7.4): 3189.81
Polar Surface Area: 33 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement