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Search term: BADLEYLQAILHPV (Found by InChIKey (skeleton match))

ChemSpider 2D Image | Piperundecalidine | C23H29NO3

Piperundecalidine

  • Molecular FormulaC23H29NO3
  • Average mass367.481 Da
  • Monoisotopic mass367.214752 Da
  • ChemSpider ID23321098
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E,4E,10E)-11-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,10-undecatrien-1-on [German] [ACD/IUPAC Name]
(2E,4E,10E)-11-(1,3-Benzodioxol-5-yl)-1-(1-piperidinyl)-2,4,10-undecatrien-1-one [ACD/IUPAC Name]
(2E,4E,10E)-11-(1,3-Benzodioxol-5-yl)-1-(1-pipéridinyl)-2,4,10-undécatrién-1-one [French] [ACD/IUPAC Name]
(2E,4E,10E)-11-(1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)undeca-2,4,10-trien-1-one
2,4,10-Undecatrien-1-one, 11-(1,3-benzodioxol-5-yl)-1-(1-piperidinyl)-, (2E,4E,10E)- [ACD/Index Name]
88660-11-1 [RN]
Piperundecalidine
(2E,4E,10E)-11-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)undeca-2,4,10-trien-1-one
(2E,4E,10E)-11-(benzo[d][1,3]dioxol-5-yl)-1-(piperidin-1-yl)undeca-2,4,10-trien-1-one
1-[11-(1,3-Benzodioxol-5-yl)-1-oxo-2,4,10-undecatrienyl]piperidine, 9CI
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 591.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.3±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 110.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.16
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 970.44
ACD/KOC (pH 5.5): 4782.69
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 970.44
ACD/KOC (pH 7.4): 4782.69
Polar Surface Area: 39 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 328.1±3.0 cm3

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