ChemSpider 2D Image | Methyl 4-isobutyl-2-methyl-1H-imidazole-5-carboxylate | C10H16N2O2

Methyl 4-isobutyl-2-methyl-1H-imidazole-5-carboxylate

  • Molecular FormulaC10H16N2O2
  • Average mass196.246 Da
  • Monoisotopic mass196.121185 Da
  • ChemSpider ID23499501

More details:

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

1150617-77-8 [RN]
Methyl 4-isobutyl-2-methyl-1H-imidazole-5-carboxylate [ACD/IUPAC Name]
4-(Diethylamino)-2-methoxybenzaldehyde [ACD/IUPAC Name]
4-(diethylamino)-2-methoxy-benzaldehyde;4-Diethylamino-2-methoxybenzaldehyde
METHYL 2-METHYL-4-(2-METHYLPROPYL)-1H-IMIDAZOLE-5-CARBOXYLATE
METHYL 2-METHYL-5-(2-METHYLPROPYL)-1H-IMIDAZOLE-4-CARBOXYLATE
METHYL 2-METHYL-5-(2-METHYLPROPYL)-3H-IMIDAZOLE-4-CARBOXYLATE
Methyl 4-isobutyl-2-methyl-1H-imidazol-5-carboxylate
methyl4-isobutyl-2-methyl-1H-imidazole-5-carboxylate
MFCD11111584

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

Density: 1.1±0.1 g/cm3
Boiling Point: 380.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 183.6±24.6 °C
Index of Refraction: 1.509
Molar Refractivity: 54.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 18.34
ACD/KOC (pH 5.5): 267.88
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.19
ACD/KOC (pH 7.4): 309.47
Polar Surface Area: 55 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 181.4±3.0 cm3

Click to predict properties on the Chemicalize site


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