ChemSpider 2D Image | (2Z)-7-Amino-2-(4-hydroxy-3,5-dimethylbenzylidene)-5,6-dimethoxy-1-indanone | C20H21NO4

(2Z)-7-Amino-2-(4-hydroxy-3,5-dimethylbenzylidene)-5,6-dimethoxy-1-indanone

  • Molecular FormulaC20H21NO4
  • Average mass339.385 Da
  • Monoisotopic mass339.147064 Da
  • ChemSpider ID24627637

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-7-Amino-2-(4-hydroxy-3,5-dimethylbenzyliden)-5,6-dimethoxy-1-indanon [German] [ACD/IUPAC Name]
(2Z)-7-Amino-2-(4-hydroxy-3,5-dimethylbenzylidene)-5,6-dimethoxy-1-indanone [ACD/IUPAC Name]
(2Z)-7-Amino-2-(4-hydroxy-3,5-diméthylbenzylidène)-5,6-diméthoxy-1-indanone [French] [ACD/IUPAC Name]
1H-Inden-1-one, 7-amino-2,3-dihydro-2-[(4-hydroxy-3,5-dimethylphenyl)methylene]-5,6-dimethoxy-, (2Z)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 580.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.0±3.0 kJ/mol
Flash Point: 304.7±30.1 °C
Index of Refraction: 1.667
Molar Refractivity: 98.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 353.02
ACD/KOC (pH 5.5): 2319.08
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 352.36
ACD/KOC (pH 7.4): 2314.71
Polar Surface Area: 82 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 264.1±3.0 cm3

Click to predict properties on the Chemicalize site


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