Found 3 results

Search term: RTQBHSJQNWVSGE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2S)-2-Propyl-1,2,3,4-tetrahydroquinoline | C12H17N

(2S)-2-Propyl-1,2,3,4-tetrahydroquinoline

  • Molecular FormulaC12H17N
  • Average mass175.270 Da
  • Monoisotopic mass175.136093 Da
  • ChemSpider ID27471038

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Propyl-1,2,3,4-tetrahydroquinoline [ACD/IUPAC Name]
935476-65-6 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 289.8±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.9±3.0 kJ/mol
Flash Point: 133.2±14.4 °C
Index of Refraction: 1.510
Molar Refractivity: 55.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 196.85
ACD/KOC (pH 5.5): 1374.04
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 283.58
ACD/KOC (pH 7.4): 1979.40
Polar Surface Area: 12 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 34.0±3.0 dyne/cm
Molar Volume: 186.4±3.0 cm3

Click to predict properties on the Chemicalize site


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