ChemSpider 2D Image | (3R,4S)-3-Nitro-4-(2-nitrophenyl)-3,4-dihydro-2H-benzo[g]chromene-5,10-dione | C19H12N2O7

(3R,4S)-3-Nitro-4-(2-nitrophenyl)-3,4-dihydro-2H-benzo[g]chromene-5,10-dione

  • Molecular FormulaC19H12N2O7
  • Average mass380.308 Da
  • Monoisotopic mass380.064453 Da
  • ChemSpider ID32779635

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4S)-3-Nitro-4-(2-nitrophenyl)-3,4-dihydro-2H-benzo[g]chromen-5,10-dion [German] [ACD/IUPAC Name]
(3R,4S)-3-Nitro-4-(2-nitrophenyl)-3,4-dihydro-2H-benzo[g]chromene-5,10-dione [ACD/IUPAC Name]
(3R,4S)-3-Nitro-4-(2-nitrophényl)-3,4-dihydro-2H-benzo[g]chromène-5,10-dione [French] [ACD/IUPAC Name]
2H-Naphtho[2,3-b]pyran-5,10-dione, 3,4-dihydro-3-nitro-4-(2-nitrophenyl)-, (3R,4S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 599.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.3±3.0 kJ/mol
Flash Point: 261.2±32.1 °C
Index of Refraction: 1.690
Molar Refractivity: 93.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.03
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 43.97
ACD/KOC (pH 5.5): 324.73
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 1.41
ACD/KOC (pH 7.4): 10.38
Polar Surface Area: 135 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 75.8±5.0 dyne/cm
Molar Volume: 244.0±5.0 cm3

Click to predict properties on the Chemicalize site


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