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ChemSpider 2D Image | 2-Hydroxy-3-isopropoxypropyl 1-piperidinecarbodithioate | C12H23NO2S2

2-Hydroxy-3-isopropoxypropyl 1-piperidinecarbodithioate

  • Molecular FormulaC12H23NO2S2
  • Average mass277.447 Da
  • Monoisotopic mass277.117004 Da
  • ChemSpider ID57466715

More details:






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

1-Pipéridinecarbodithioate de 2-hydroxy-3-isopropoxypropyle [French] [ACD/IUPAC Name]
1-Piperidinecarbodithioic acid, 2-hydroxy-3-(1-methylethoxy)propyl ester [ACD/Index Name]
2-Hydroxy-3-isopropoxypropyl 1-piperidinecarbodithioate [ACD/IUPAC Name]
2-Hydroxy-3-isopropoxypropyl-1-piperidincarbodithioat [German] [ACD/IUPAC Name]
1-PIPERIDINECARBODITHIOIC ACID, 2-HYDROXY-3-(1-METHYLETHOXY)PROPYLESTER

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

Density: 1.2±0.1 g/cm3
Boiling Point: 403.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.6±6.0 kJ/mol
Flash Point: 197.7±31.5 °C
Index of Refraction: 1.565
Molar Refractivity: 77.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 25.06
ACD/KOC (pH 5.5): 349.17
ACD/LogD (pH 7.4): 2.14
ACD/BCF (pH 7.4): 25.06
ACD/KOC (pH 7.4): 349.18
Polar Surface Area: 90 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 237.8±3.0 cm3

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