ChemSpider 2D Image | 4-(5-Chloro-2-thienyl)-1-isopropyl-4-piperidinol | C12H18ClNOS

4-(5-Chloro-2-thienyl)-1-isopropyl-4-piperidinol

  • Molecular FormulaC12H18ClNOS
  • Average mass259.795 Da
  • Monoisotopic mass259.079773 Da
  • ChemSpider ID35330876

More details:

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

1443310-77-7 [RN]
4-(5-Chlor-2-thienyl)-1-isopropyl-4-piperidinol [German] [ACD/IUPAC Name]
4-(5-Chloro-2-thienyl)-1-isopropyl-4-piperidinol [ACD/IUPAC Name]
4-(5-Chloro-2-thiényl)-1-isopropyl-4-pipéridinol [French] [ACD/IUPAC Name]
4-(5-CHLOROTHIOPHEN-2-YL)-1-(PROPAN-2-YL)PIPERIDIN-4-OL
4-Piperidinol, 4-(5-chloro-2-thienyl)-1-(1-methylethyl)- [ACD/Index Name]
4-(2-Chloro-5-thienyl)-4-hydroxy-1-iso-propylpiperidine
4-(5-Chlorothiophen-2-yl)-1-isopropylpiperidin-4-ol
4-(5-chlorothiophen-2-yl)-1-propan-2-ylpiperidin-4-ol
atoms 16 bonds 17
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 380.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 66.3±3.0 kJ/mol
    Flash Point: 184.0±27.9 °C
    Index of Refraction: 1.576
    Molar Refractivity: 69.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.01
    ACD/LogD (pH 5.5): -0.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.52
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 7.82
    Polar Surface Area: 52 Å2
    Polarizability: 27.6±0.5 10-24cm3
    Surface Tension: 47.9±3.0 dyne/cm
    Molar Volume: 210.7±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement