ChemSpider 2D Image | {4-[1-(1-Piperidinyl)cyclohexyl]phenyl}methanethiol | C18H27NS

{4-[1-(1-Piperidinyl)cyclohexyl]phenyl}methanethiol

  • Molecular FormulaC18H27NS
  • Average mass289.479 Da
  • Monoisotopic mass289.186432 Da
  • ChemSpider ID57432701

More details:

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

{4-[1-(1-Piperidinyl)cyclohexyl]phenyl}methanethiol [ACD/IUPAC Name]
{4-[1-(1-Pipéridinyl)cyclohexyl]phényl}méthanethiol [French] [ACD/IUPAC Name]
{4-[1-(1-Piperidinyl)cyclohexyl]phenyl}methanthiol [German] [ACD/IUPAC Name]
Benzenemethanethiol, 4-[1-(1-piperidinyl)cyclohexyl]- [ACD/Index Name]
(4-(1-(Piperidin-1-yl)cyclohexyl)phenyl)methanethiol
{4-[1-(Piperidin-1-yl)cyclohexyl]phenyl}methanethiol
88208-03-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 408.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.1±3.0 kJ/mol
Flash Point: 200.9±23.2 °C
Index of Refraction: 1.576
Molar Refractivity: 89.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 7.17
ACD/KOC (pH 5.5): 25.61
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 338.48
ACD/KOC (pH 7.4): 1208.49
Polar Surface Area: 42 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 270.6±3.0 cm3

Click to predict properties on the Chemicalize site


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