Found 9 results

Search term: NTVLUSJWJRSPSM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 2-[(2Z)-1-oxo-2-buten-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate | C21H22N2O3

Methyl 2-[(2Z)-1-oxo-2-buten-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate

  • Molecular FormulaC21H22N2O3
  • Average mass350.411 Da
  • Monoisotopic mass350.163055 Da
  • ChemSpider ID64883655

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(2Z)-1-Oxo-2-butén-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Indolo[2,3-a]quinolizine-3-carboxylic acid, 2-[(1Z)-1-formyl-1-propen-1-yl]-1,2,6,7,12,12b-hexahydro-, methyl ester [ACD/Index Name]
Methyl 2-[(2Z)-1-oxo-2-buten-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]quinolizine-3-carboxylate [ACD/IUPAC Name]
Methyl-2-[(2Z)-1-oxo-2-buten-2-yl]-1,2,6,7,12,12b-hexahydroindolo[2,3-a]chinolizin-3-carboxylat [German] [ACD/IUPAC Name]
5523-37-5 [RN]
Vallesiachotamine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 566.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.6±30.1 °C
Index of Refraction: 1.654
Molar Refractivity: 99.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.21
ACD/LogD (pH 5.5): 2.52
ACD/BCF (pH 5.5): 33.62
ACD/KOC (pH 5.5): 278.85
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 148.44
ACD/KOC (pH 7.4): 1231.11
Polar Surface Area: 62 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 59.1±5.0 dyne/cm
Molar Volume: 272.1±5.0 cm3

Click to predict properties on the Chemicalize site


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