ChemSpider 2D Image | 3-(1-Benzyl-3-piperidinyl)-1-propanethiol | C15H23NS

3-(1-Benzyl-3-piperidinyl)-1-propanethiol

  • Molecular FormulaC15H23NS
  • Average mass249.415 Da
  • Monoisotopic mass249.155121 Da
  • ChemSpider ID29302884

More details:

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

3-(1-Benzyl-3-piperidinyl)-1-propanethiol [ACD/IUPAC Name]
3-(1-Benzyl-3-pipéridinyl)-1-propanethiol [French] [ACD/IUPAC Name]
3-(1-Benzyl-3-piperidinyl)-1-propanthiol [German] [ACD/IUPAC Name]
3-Piperidinepropanethiol, 1-(phenylmethyl)- [ACD/Index Name]
1420894-66-1 [RN]
3-(1-benzylpiperidin-3-yl)propane-1-thiol
MFCD24381697

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

Density: 1.0±0.1 g/cm3
Boiling Point: 351.7±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.6±3.0 kJ/mol
Flash Point: 166.5±20.4 °C
Index of Refraction: 1.549
Molar Refractivity: 77.6±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.08
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 13.24
ACD/KOC (pH 7.4): 69.58
Polar Surface Area: 42 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 39.6±3.0 dyne/cm
Molar Volume: 243.9±3.0 cm3

Click to predict properties on the Chemicalize site


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