ChemSpider 2D Image | 2E9874M295 | C10H20O2

2E9874M295

  • Molecular FormulaC10H20O2
  • Average mass172.265 Da
  • Monoisotopic mass172.146332 Da
  • ChemSpider ID52084699

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,4S)-2-Isobutyl-4-methyltetrahydro-2H-pyran-4-ol [German] [ACD/IUPAC Name]
(2R,4S)-2-Isobutyl-4-methyltetrahydro-2H-pyran-4-ol [ACD/IUPAC Name]
(2R,4S)-2-Isobutyl-4-méthyltétrahydro-2H-pyran-4-ol [French] [ACD/IUPAC Name]
(2R,4S)-2-isobutyl-4-methyltetrahydropyran-4-ol
2E9874M295
2H-Pyran-4-ol, tetrahydro-4-methyl-2-(2-methylpropyl)-, (2R,4S)- [ACD/Index Name]
724776-61-8 [RN]
2-ISOBUTYL-4-METHYLTETRAHYDROPYRAN-4-OL, (2R,4S)-
UNII:2E9874M295

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

Density: 0.9±0.1 g/cm3
Boiling Point: 243.0±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 55.8±6.0 kJ/mol
Flash Point: 88.0±12.7 °C
Index of Refraction: 1.450
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.49
ACD/KOC (pH 5.5): 429.64
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.49
ACD/KOC (pH 7.4): 429.64
Polar Surface Area: 29 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 31.7±3.0 dyne/cm
Molar Volume: 183.9±3.0 cm3

Click to predict properties on the Chemicalize site


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