ChemSpider 2D Image | 2-(Isopentylamino)naphthalene-1,4-dione | C15H17NO2

2-(Isopentylamino)naphthalene-1,4-dione

  • Molecular FormulaC15H17NO2
  • Average mass243.301 Da
  • Monoisotopic mass243.125931 Da
  • ChemSpider ID97091830

More details:

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

1,4-Naphthalenedione, 2-[(3-methylbutyl)amino]- [ACD/Index Name]
1607447-79-9 [RN]
2-(Isopentylamino)naphthalene-1,4-dione
2-[(3-Methylbutyl)amino]-1,4-naphthochinon [German] [ACD/IUPAC Name]
2-[(3-Methylbutyl)amino]-1,4-naphthoquinone [ACD/IUPAC Name]
2-[(3-Méthylbutyl)amino]-1,4-naphtoquinone [French] [ACD/IUPAC Name]
2-(3-methylbutylamino)naphthalene-1,4-dione
2-[(3-methylbutyl)amino]-1,4-naphthalenedione

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

Density: 1.1±0.1 g/cm3
Boiling Point: 381.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 142.7±28.0 °C
Index of Refraction: 1.567
Molar Refractivity: 69.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 122.39
ACD/KOC (pH 5.5): 1086.26
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.48
ACD/KOC (pH 7.4): 1087.04
Polar Surface Area: 46 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 44.6±5.0 dyne/cm
Molar Volume: 214.2±5.0 cm3

Click to predict properties on the Chemicalize site


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