ChemSpider 2D Image | 1-{4-[(2-Isopropoxyethoxy)methyl]phenoxy}-3-[isopropyl(~2~H)amino]-2-propan(~2~H)ol | C18H29D2NO4

1-{4-[(2-Isopropoxyethoxy)methyl]phenoxy}-3-[isopropyl(2H)amino]-2-propan(2H)ol

  • Molecular FormulaC18H29D2NO4
  • Average mass327.455 Da
  • Monoisotopic mass327.237854 Da
  • ChemSpider ID95685084

  • Non-standard isotope - Non-standard isotope

More details:

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

1-{4-[(2-Isopropoxyethoxy)methyl]phenoxy}-3-[isopropyl(2H)amino]-2-propan(2H)ol [German] [ACD/IUPAC Name]
1-{4-[(2-Isopropoxyethoxy)methyl]phenoxy}-3-[isopropyl(2H)amino]-2-propan(2H)ol [ACD/IUPAC Name]
1-{4-[(2-Isopropoxyéthoxy)méthyl]phénoxy}-3-[isopropyl(2H)amino]-2-propan(2H)ol [French] [ACD/IUPAC Name]
2-Propanol-d, 1-[4-[[2-(1-methylethoxy)ethoxy]methyl]phenoxy]-3-[(1-methylethyl)amino-d]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 445.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 222.9±28.7 °C
Index of Refraction: 1.500
Molar Refractivity: 92.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.09
Polar Surface Area: 60 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 315.0±3.0 cm3

Click to predict properties on the Chemicalize site


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