ChemSpider 2D Image | (2S)-1-tert-Butoxypropan-2-ol | C7H16O2

(2S)-1-tert-Butoxypropan-2-ol

  • Molecular FormulaC7H16O2
  • Average mass132.201 Da
  • Monoisotopic mass132.115036 Da
  • ChemSpider ID21391629

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-[(2-Methyl-2-propanyl)oxy]-2-propanol [ACD/IUPAC Name]
(2S)-1-[(2-Methyl-2-propanyl)oxy]-2-propanol [German] [ACD/IUPAC Name]
(2S)-1-[(2-Méthyl-2-propanyl)oxy]-2-propanol [French] [ACD/IUPAC Name]
(2S)-1-tert-Butoxypropan-2-ol
2-Propanol, 1-(1,1-dimethylethoxy)-, (2S)- [ACD/Index Name]
(2R)-1-[(2-methylpropan-2-yl)oxy]propan-2-ol
(2R)-1-tert-Butoxypropan-2-ol
(2S)-1-(tert-butoxy)propan-2-ol
(2S)-1-[(2-methylpropan-2-yl)oxy]-2-propanol
(2S)-1-[(2-methylpropan-2-yl)oxy]propan-2-ol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 155.3±8.0 °C at 760 mmHg
Vapour Pressure: 1.1±0.6 mmHg at 25°C
Enthalpy of Vaporization: 45.7±6.0 kJ/mol
Flash Point: 49.7±7.7 °C
Index of Refraction: 1.422
Molar Refractivity: 37.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.78
ACD/LogD (pH 5.5): 0.97
ACD/BCF (pH 5.5): 3.24
ACD/KOC (pH 5.5): 80.70
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 3.24
ACD/KOC (pH 7.4): 80.70
Polar Surface Area: 29 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 27.4±3.0 dyne/cm
Molar Volume: 148.4±3.0 cm3

Click to predict properties on the Chemicalize site


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