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Search term: BFOZYEAQPUMNIY (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-1-propanone | C14H19NO3

1-(1,3-Benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-1-propanone

  • Molecular FormulaC14H19NO3
  • Average mass249.306 Da
  • Monoisotopic mass249.136490 Da
  • ChemSpider ID107437104

More details:






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

1-(1,3-Benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-1-propanon [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2-[(2-methyl-2-propanyl)amino]-1-propanone [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2-[(2-méthyl-2-propanyl)amino]-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-(1,3-benzodioxol-5-yl)-2-[(1,1-dimethylethyl)amino]- [ACD/Index Name]
186028-84-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 375.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 180.6±27.9 °C
Index of Refraction: 1.530
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.53
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 4.62
ACD/KOC (pH 7.4): 74.42
Polar Surface Area: 48 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 223.9±3.0 cm3

Click to predict properties on the Chemicalize site






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