ChemSpider 2D Image | (R)-N-hydroxy-3,4-methylenedioxyamphetamine | C10H13NO3

(R)-N-hydroxy-3,4-methylenedioxyamphetamine

  • Molecular FormulaC10H13NO3
  • Average mass195.215 Da
  • Monoisotopic mass195.089539 Da
  • ChemSpider ID52084749

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-(1,3-Benzodioxol-5-yl)-N-hydroxy-2-propanamin [German] [ACD/IUPAC Name]
(2R)-1-(1,3-Benzodioxol-5-yl)-N-hydroxy-2-propanamine [ACD/IUPAC Name]
(2R)-1-(1,3-Benzodioxol-5-yl)-N-hydroxy-2-propanamine [French] [ACD/IUPAC Name]
(R)-N-hydroxy-3,4-methylenedioxyamphetamine
1,3-Benzodioxole-5-ethanamine, N-hydroxy-α-methyl-, (αR)- [ACD/Index Name]
198017-93-5 [RN]
N-HYDROXY-3,4-METHYLENEDIOXYAMPHETAMINE, (R)-

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

WF257A80MT [DBID]
UNII:WF257A80MT [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 349.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 165.3±30.7 °C
Index of Refraction: 1.574
Molar Refractivity: 51.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 2.75
ACD/KOC (pH 5.5): 51.23
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.78
ACD/KOC (pH 7.4): 163.48
Polar Surface Area: 51 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 52.2±3.0 dyne/cm
Molar Volume: 156.6±3.0 cm3

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