ChemSpider 2D Image | 1-tert-Butoxy-3-methylbutane | C9H20O

1-tert-Butoxy-3-methylbutane

  • Molecular FormulaC9H20O
  • Average mass144.255 Da
  • Monoisotopic mass144.151413 Da
  • ChemSpider ID10643186

More details:






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

1-tert-Butoxy-3-methylbutane
3-Methyl-1-[(2-methyl-2-propanyl)oxy]butan [German] [ACD/IUPAC Name]
3-Methyl-1-[(2-methyl-2-propanyl)oxy]butane [ACD/IUPAC Name]
3-Méthyl-1-[(2-méthyl-2-propanyl)oxy]butane [French] [ACD/IUPAC Name]
Butane, 1-(1,1-dimethylethoxy)-3-methyl- [ACD/Index Name]
tert-Butyl 3-methylbutyl ether
1-(1,1-Dimethylethoxy)-3-methylbutane
92097-05-7 [RN]
Isopentyl tert.-butyl ether

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.8±0.1 g/cm3
Boiling Point: 139.9±8.0 °C at 760 mmHg
Vapour Pressure: 7.9±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.2±3.0 kJ/mol
Flash Point: 27.1±10.2 °C
Index of Refraction: 1.409
Molar Refractivity: 45.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 203.31
ACD/KOC (pH 5.5): 1562.40
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 203.31
ACD/KOC (pH 7.4): 1562.40
Polar Surface Area: 9 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 22.9±3.0 dyne/cm
Molar Volume: 183.9±3.0 cm3

Click to predict properties on the Chemicalize site






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