ChemSpider 2D Image | 5-METHYLETHYLONE | C13H17NO3

5-METHYLETHYLONE

  • Molecular FormulaC13H17NO3
  • Average mass235.279 Da
  • Monoisotopic mass235.120850 Da
  • ChemSpider ID52084944

More details:

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

1364933-82-3 [RN]
1-Propanone, 2-(ethylamino)-1-(7-methyl-1,3-benzodioxol-5-yl)- [ACD/Index Name]
2-(Ethylamino)-1-(7-methyl-1,3-benzodioxol-5-yl)-1-propanon [German] [ACD/IUPAC Name]
2-(Ethylamino)-1-(7-methyl-1,3-benzodioxol-5-yl)-1-propanone [ACD/IUPAC Name]
2-(Éthylamino)-1-(7-méthyl-1,3-benzodioxol-5-yl)-1-propanone [French] [ACD/IUPAC Name]
5-METHYLETHYLONE

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

3U77H8TN7N [DBID]
UNII:3U77H8TN7N [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 379.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 183.0±27.9 °C
Index of Refraction: 1.537
Molar Refractivity: 64.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.01
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 6.26
ACD/KOC (pH 7.4): 108.02
Polar Surface Area: 48 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 207.1±3.0 cm3

Click to predict properties on the Chemicalize site


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