Found 1 result

Search term: C[C@H]1O[C@H](O)CC[C@@H]1N(C)C (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | (2S,5S,6R)-5-(Dimethylamino)-6-methyltetrahydro-2H-pyran-2-ol | C8H17NO2

(2S,5S,6R)-5-(Dimethylamino)-6-methyltetrahydro-2H-pyran-2-ol

  • Molecular FormulaC8H17NO2
  • Average mass159.226 Da
  • Monoisotopic mass159.125931 Da
  • ChemSpider ID61636210

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,5S,6R)-5-(Dimethylamino)-6-methyltetrahydro-2H-pyran-2-ol [German] [ACD/IUPAC Name]
(2S,5S,6R)-5-(Dimethylamino)-6-methyltetrahydro-2H-pyran-2-ol [ACD/IUPAC Name]
(2S,5S,6R)-5-(Diméthylamino)-6-méthyltétrahydro-2H-pyran-2-ol [French] [ACD/IUPAC Name]
2H-Pyran-2-ol, 5-(dimethylamino)tetrahydro-6-methyl-, (2S,5S,6R)- [ACD/Index Name]
56587-32-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 240.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.5±6.0 kJ/mol
Flash Point: 99.2±27.3 °C
Index of Refraction: 1.483
Molar Refractivity: 44.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.15
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.63
Polar Surface Area: 33 Å2
Polarizability: 17.5±0.5 10-24cm3
Surface Tension: 35.8±5.0 dyne/cm
Molar Volume: 154.6±5.0 cm3

Click to predict properties on the Chemicalize site


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