ChemSpider 2D Image | 1-(Hexyloxy)-1-(3-methylbutoxy)hexane | C17H36O2

1-(Hexyloxy)-1-(3-methylbutoxy)hexane

  • Molecular FormulaC17H36O2
  • Average mass272.466 Da
  • Monoisotopic mass272.271515 Da
  • ChemSpider ID21105913

More details:

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

1-(Hexyloxy)-1-(3-methylbutoxy)hexan [German] [ACD/IUPAC Name]
1-(Hexyloxy)-1-(3-methylbutoxy)hexane [ACD/IUPAC Name]
1-(Hexyloxy)-1-(3-méthylbutoxy)hexane [French] [ACD/IUPAC Name]
1-(Hexyloxy)-1-(3-methylbutyloxy)hexane
1-Hexyloxy-1-(3-methylbutoxy)hexane
37847768 [Beilstein]
6OY5&O2Y1&1 [WLN]
896447-13-5 [RN]
Hexanal hexyl isoamyl acetal
Hexane, 1-(hexyloxy)-1-(3-methylbutoxy)- [ACD/Index Name]

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

7ZP0QL6F0R [DBID]
UNII:7ZP0QL6F0R [DBID]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 255.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.3±3.0 kJ/mol
Flash Point: 49.4±18.0 °C
Index of Refraction: 1.435
Molar Refractivity: 84.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 6.81
ACD/LogD (pH 5.5): 6.12
ACD/BCF (pH 5.5): 26226.93
ACD/KOC (pH 5.5): 50643.59
ACD/LogD (pH 7.4): 6.12
ACD/BCF (pH 7.4): 26226.93
ACD/KOC (pH 7.4): 50643.59
Polar Surface Area: 18 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 28.1±3.0 dyne/cm
Molar Volume: 322.6±3.0 cm3

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