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Search term: YBMARPZCTRNEOC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-N,3,3-trimethyl-2-butanamine | C14H21NO2

1-(1,3-Benzodioxol-5-yl)-N,3,3-trimethyl-2-butanamine

  • Molecular FormulaC14H21NO2
  • Average mass235.322 Da
  • Monoisotopic mass235.157227 Da
  • ChemSpider ID34249620

More details:

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

1-(1,3-Benzodioxol-5-yl)-N,3,3-trimethyl-2-butanamin [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N,3,3-trimethyl-2-butanamine [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N,3,3-triméthyl-2-butanamine [French] [ACD/IUPAC Name]
1,3-Benzodioxole-5-ethanamine, α-(1,1-dimethylethyl)-N-methyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 320.5±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.2±3.0 kJ/mol
Flash Point: 135.4±8.7 °C
Index of Refraction: 1.522
Molar Refractivity: 68.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.03
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.06
Polar Surface Area: 30 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 37.9±3.0 dyne/cm
Molar Volume: 225.2±3.0 cm3

Click to predict properties on the Chemicalize site


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