ChemSpider 2D Image | {2-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]ethoxy}acetic acid | C18H28O4

{2-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]ethoxy}acetic acid

  • Molecular FormulaC18H28O4
  • Average mass308.413 Da
  • Monoisotopic mass308.198761 Da
  • ChemSpider ID28719811

More details:






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

{2-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]ethoxy}acetic acid [ACD/IUPAC Name]
{2-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]ethoxy}essigsäure [German] [ACD/IUPAC Name]
108241-00-5 [RN]
2-[2-[4-(1,1,3,3-Tetramethylbutyl)phenoxy]ethoxy]acetic acid
Acetic acid, 2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]- [ACD/Index Name]
Acide {2-[4-(2,4,4-triméthyl-2-pentanyl)phénoxy]éthoxy}acétique [French] [ACD/IUPAC Name]
{2-[4-(2,4,4-TRIMETHYLPENTAN-2-YL)PHENOXY]ETHOXY}ACETIC ACID
2-(2-(4-(2,4,4-Trimethylpentan-2-yl)phenoxy)ethoxy)acetic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 443.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 151.6±19.4 °C
Index of Refraction: 1.498
Molar Refractivity: 87.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 12.97
ACD/KOC (pH 5.5): 54.77
ACD/LogD (pH 7.4): 0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.93
Polar Surface Area: 56 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 296.7±3.0 cm3

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