ChemSpider 2D Image | Inflachromene | C21H19N3O4

Inflachromene

  • Molecular FormulaC21H19N3O4
  • Average mass377.393 Da
  • Monoisotopic mass377.137543 Da
  • ChemSpider ID26647647

More details:

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

10-Hydroxy-7,7-dimethyl-2-phenyl-5,12b-dihydro-1H,7H-chromeno[4,3-c][1,2,4]triazolo[1,2-a]pyridazin-1,3(2H)-dion [German] [ACD/IUPAC Name]
10-Hydroxy-7,7-dimethyl-2-phenyl-5,12b-dihydro-1H,7H-chromeno[4,3-c][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione [ACD/IUPAC Name]
10-Hydroxy-7,7-diméthyl-2-phényl-5,12b-dihydro-1H,7H-chroméno[4,3-c][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione [French] [ACD/IUPAC Name]
1H,7H-[1]Benzopyrano[4,3-c][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione, 5,12b-dihydro-10-hydroxy-7,7-dimethyl-2-phenyl- [ACD/Index Name]
5-hydroxy-9,9-dimethyl-15-phenyl-8-oxa-13,15,17-triazatetracyclo[8.7.0.0²,?.0¹³,¹?]heptadeca-2(7),3,5,10-tetraene-14,16-dione
908568-01-4 [RN]
Inflachromene
[908568-01-4] [RN]
5,12b-dihydro-10-hydroxy-7,7-dimethyl-2-phenyl-1H,7H-[1]benzopyrano[4,3-c][1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione

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

Density: 1.5±0.1 g/cm3
Boiling Point: 532.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 275.9±32.9 °C
Index of Refraction: 1.747
Molar Refractivity: 101.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 15.16
ACD/KOC (pH 5.5): 243.65
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 15.06
ACD/KOC (pH 7.4): 241.98
Polar Surface Area: 73 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 80.5±5.0 dyne/cm
Molar Volume: 250.6±5.0 cm3

Click to predict properties on the Chemicalize site


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