ChemSpider 2D Image | 2-Amino-3-methoxy-6-methyl-5-[(2E)-3-methyl-2-hexen-1-yl]-1,4-benzoquinone | C15H21NO3

2-Amino-3-methoxy-6-methyl-5-[(2E)-3-methyl-2-hexen-1-yl]-1,4-benzoquinone

  • Molecular FormulaC15H21NO3
  • Average mass263.332 Da
  • Monoisotopic mass263.152130 Da
  • ChemSpider ID35034323

  • Double-bond stereo - Double-bond stereo

More details:

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

2,5-Cyclohexadiene-1,4-dione, 2-amino-3-methoxy-6-methyl-5-[(2E)-3-methyl-2-hexen-1-yl]- [ACD/Index Name]
2-Amino-3-methoxy-6-methyl-5-[(2E)-3-methyl-2-hexen-1-yl]-1,4-benzochinon [German] [ACD/IUPAC Name]
2-Amino-3-methoxy-6-methyl-5-[(2E)-3-methyl-2-hexen-1-yl]-1,4-benzoquinone [ACD/IUPAC Name]
2-Amino-3-méthoxy-6-méthyl-5-[(2E)-3-méthyl-2-hexén-1-yl]-1,4-benzoquinone [French] [ACD/IUPAC Name]
2-Amino-3-Methoxy-6-Methyl-5-[(2e)-3-Methylhex-2-En-1-Yl]cyclohexa-2,5-Diene-1,4-Dione

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

Density: 1.1±0.1 g/cm3
Boiling Point: 387.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 146.8±24.2 °C
Index of Refraction: 1.525
Molar Refractivity: 73.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.65
ACD/KOC (pH 5.5): 374.64
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.65
ACD/KOC (pH 7.4): 374.65
Polar Surface Area: 69 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 40.3±5.0 dyne/cm
Molar Volume: 240.4±5.0 cm3

Click to predict properties on the Chemicalize site


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