ChemSpider 2D Image | 6-[(2R)-2-Aminopropyl]-1,3-benzodioxol-5-ol | C10H13NO3

6-[(2R)-2-Aminopropyl]-1,3-benzodioxol-5-ol

  • Molecular FormulaC10H13NO3
  • Average mass195.215 Da
  • Monoisotopic mass195.089539 Da
  • ChemSpider ID57469947

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1,3-Benzodioxol-5-ol, 6-[(2R)-2-aminopropyl]- [ACD/Index Name]
6-[(2R)-2-Aminopropyl]-1,3-benzodioxol-5-ol [German] [ACD/IUPAC Name]
6-[(2R)-2-Aminopropyl]-1,3-benzodioxol-5-ol [ACD/IUPAC Name]
6-[(2R)-2-Aminopropyl]-1,3-benzodioxol-5-ol [French] [ACD/IUPAC Name]
2-hydroxy-4,5-methylenedioxyamphetamine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 349.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.7±3.0 kJ/mol
Flash Point: 165.0±27.9 °C
Index of Refraction: 1.598
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): -2.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 152.4±3.0 cm3

Click to predict properties on the Chemicalize site


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