ChemSpider 2D Image | {[(2R)-4-Iodo-2-methylbutoxy]methyl}benzene | C12H17IO

{[(2R)-4-Iodo-2-methylbutoxy]methyl}benzene

  • Molecular FormulaC12H17IO
  • Average mass304.167 Da
  • Monoisotopic mass304.032410 Da
  • ChemSpider ID21169093

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

{[(2R)-4-Iod-2-methylbutoxy]methyl}benzol [German] [ACD/IUPAC Name]
{[(2R)-4-Iodo-2-methylbutoxy]methyl}benzene [ACD/IUPAC Name]
{[(2R)-4-Iodo-2-méthylbutoxy]méthyl}benzène [French] [ACD/IUPAC Name]
Benzene, [[(2R)-4-iodo-2-methylbutoxy]methyl]- [ACD/Index Name]
(R)-Benzyl 4-iodo-2-methylbutyl ether

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

nchembio.74-comp6 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 308.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 140.5±23.2 °C
Index of Refraction: 1.559
Molar Refractivity: 69.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 617.59
ACD/KOC (pH 5.5): 3460.87
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 617.59
ACD/KOC (pH 7.4): 3460.87
Polar Surface Area: 9 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 213.8±3.0 cm3

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