ChemSpider 2D Image | [5-(Tetrahydro-2H-pyran-4-ylmethyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl](2,2,3,3-tetramethylcyclopropyl)methanone | C23H29NO4

[5-(Tetrahydro-2H-pyran-4-ylmethyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl](2,2,3,3-tetramethylcyclopropyl)methanone

  • Molecular FormulaC23H29NO4
  • Average mass383.481 Da
  • Monoisotopic mass383.209656 Da
  • ChemSpider ID23325310

More details:

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

[5-(Tetrahydro-2H-pyran-4-ylmethyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl](2,2,3,3-tetramethylcyclopropyl)methanon [German] [ACD/IUPAC Name]
[5-(Tetrahydro-2H-pyran-4-ylmethyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl](2,2,3,3-tetramethylcyclopropyl)methanone [ACD/IUPAC Name]
[5-(Tétrahydro-2H-pyran-4-ylméthyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl](2,2,3,3-tétraméthylcyclopropyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [5-[(tetrahydro-2H-pyran-4-yl)methyl]-5H-1,3-dioxolo[4,5-f]indol-7-yl](2,2,3,3-tetramethylcyclopropyl)- [ACD/Index Name]
(5-((tetrahydro-2H-pyran-4-yl)methyl)-5H-[1,3]dioxolo[4,5-f]indol-7-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL272868/
Tetrahydropyranyl-methyl analogue, 30

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

Density: 1.3±0.1 g/cm3
Boiling Point: 520.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.6±28.7 °C
Index of Refraction: 1.631
Molar Refractivity: 105.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1348.35
ACD/KOC (pH 5.5): 6052.17
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1348.35
ACD/KOC (pH 7.4): 6052.17
Polar Surface Area: 50 Å2
Polarizability: 41.7±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 294.9±7.0 cm3

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