ChemSpider 2D Image | UWA-101 | C13H17NO2

UWA-101

  • Molecular FormulaC13H17NO2
  • Average mass219.280 Da
  • Monoisotopic mass219.125931 Da
  • ChemSpider ID27444374

More details:






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

0N2Q1RYR1X
1,3-Benzodioxole-5-ethanamine, α-cyclopropyl-N-methyl- [ACD/Index Name]
1350821-24-7 [RN]
2-(1,3-Benzodioxol-5-yl)-1-cyclopropyl-N-methylethanamin [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-1-cyclopropyl-N-methylethanamine [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-1-cyclopropyl-N-méthyléthanamine [French] [ACD/IUPAC Name]
UNII:0N2Q1RYR1X
UWA-101 [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 327.9±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.0±3.0 kJ/mol
Flash Point: 132.9±8.7 °C
Index of Refraction: 1.580
Molar Refractivity: 61.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): -0.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 30 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 186.0±3.0 cm3

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