Found 4 results

Search term: LNSIIDDYOVTXHK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2S,3R,5S)-5-[(5S)-5-Hydroxyoctyl]-2-methyldecahydro-3-quinolinol | C18H35NO2

(2S,3R,5S)-5-[(5S)-5-Hydroxyoctyl]-2-methyldecahydro-3-quinolinol

  • Molecular FormulaC18H35NO2
  • Average mass297.476 Da
  • Monoisotopic mass297.266785 Da
  • ChemSpider ID24823236

  • defined stereocentres - 4 of 6 defined stereocentres

More details:

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

(2S,3R,5S)-5-[(5S)-5-Hydroxyoctyl]-2-methyldecahydro-3-chinolinol [German] [ACD/IUPAC Name]
(2S,3R,5S)-5-[(5S)-5-Hydroxyoctyl]-2-méthyldécahydro-3-quinoléinol [French] [ACD/IUPAC Name]
(2S,3R,5S)-5-[(5S)-5-Hydroxyoctyl]-2-methyldecahydro-3-quinolinol [ACD/IUPAC Name]
5-Quinolinepentanol, decahydro-3-hydroxy-2-methyl-α-propyl-, (αS,2S,3R,5S)- [ACD/Index Name]
5S-(5S-hydroxyoctyl)-2S-methyldecahydroquinolin-3R-ol
lepadin D

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

Density: 1.0±0.1 g/cm3
Boiling Point: 435.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 79.8±6.0 kJ/mol
Flash Point: 87.2±11.0 °C
Index of Refraction: 1.486
Molar Refractivity: 87.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.41
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.18
Polar Surface Area: 52 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 35.1±3.0 dyne/cm
Molar Volume: 305.9±3.0 cm3

Click to predict properties on the Chemicalize site


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