ChemSpider 2D Image | 5-[2-(Methylamino)propyl]-1,3-benzodioxol-4-ol | C11H15NO3

5-[2-(Methylamino)propyl]-1,3-benzodioxol-4-ol

  • Molecular FormulaC11H15NO3
  • Average mass209.242 Da
  • Monoisotopic mass209.105194 Da
  • ChemSpider ID62028239

More details:

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

1,3-Benzodioxol-4-ol, 5-[2-(methylamino)propyl]- [ACD/Index Name]
5-[2-(Methylamino)propyl]-1,3-benzodioxol-4-ol [German] [ACD/IUPAC Name]
5-[2-(Methylamino)propyl]-1,3-benzodioxol-4-ol [ACD/IUPAC Name]
5-[2-(Méthylamino)propyl]-1,3-benzodioxol-4-ol [French] [ACD/IUPAC Name]
138556-75-9 [RN]
2091750-64-8 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 322.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.7±3.0 kJ/mol
Flash Point: 148.8±27.9 °C
Index of Refraction: 1.565
Molar Refractivity: 56.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): -1.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 51 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 174.1±3.0 cm3

Click to predict properties on the Chemicalize site


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