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Search term: WHVXCZHAEQZAPK-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-Fluoro-6-methyl-1-(1-naphthylmethyl)-2,3,4,4a,9,9a-hexahydro-1H-beta-carboline | C23H23FN2

5-Fluoro-6-methyl-1-(1-naphthylmethyl)-2,3,4,4a,9,9a-hexahydro-1H-β-carboline

  • Molecular FormulaC23H23FN2
  • Average mass346.440 Da
  • Monoisotopic mass346.184540 Da
  • ChemSpider ID23182094

More details:

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

1H-Pyrido[3,4-b]indole, 5-fluoro-2,3,4,4a,9,9a-hexahydro-6-methyl-1-(1-naphthalenylmethyl)- [ACD/Index Name]
5-Fluor-6-methyl-1-(1-naphthylmethyl)-2,3,4,4a,9,9a-hexahydro-1H-β-carbolin [German] [ACD/IUPAC Name]
5-Fluoro-6-methyl-1-(1-naphthylmethyl)-2,3,4,4a,9,9a-hexahydro-1H-β-carboline [ACD/IUPAC Name]
5-Fluoro-6-méthyl-1-(1-naphtylméthyl)-2,3,4,4a,9,9a-hexahydro-1H-β-carboline [French] [ACD/IUPAC Name]
5-fluoro-6-methyl-1-(naphthalen-1-ylmethyl)-2,3,4,4a,9,9a-hexahydro-1H-β-carboline
5-Fluoro-6-methyl-1-naphthalen-1-ylmethyl-2,3,4,4a,9,9a-hexahydro-1H-β-carboline

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

Density: 1.2±0.1 g/cm3
Boiling Point: 483.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 246.3±28.7 °C
Index of Refraction: 1.623
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 8.33
ACD/KOC (pH 5.5): 22.57
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 185.48
ACD/KOC (pH 7.4): 502.42
Polar Surface Area: 24 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 295.5±3.0 cm3

Click to predict properties on the Chemicalize site


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