ChemSpider 2D Image | 2-Methyl-2-propanyl 2-(iodomethyl)-1H-pyrrole-1-carboxylate | C10H14INO2

2-Methyl-2-propanyl 2-(iodomethyl)-1H-pyrrole-1-carboxylate

  • Molecular FormulaC10H14INO2
  • Average mass307.128 Da
  • Monoisotopic mass307.006927 Da
  • ChemSpider ID29285528

More details:

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

1H-Pyrrole-1-carboxylic acid, 2-(iodomethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-(Iodométhyl)-1H-pyrrole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-(iodomethyl)-1H-pyrrole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-(iodmethyl)-1H-pyrrol-1-carboxylat [German] [ACD/IUPAC Name]
1420824-50-5 [RN]
MFCD24384735
tert-Butyl 2-(iodomethyl)-1H-pyrrole-1-carboxylate
TERT-BUTYL 2-(IODOMETHYL)PYRROLE-1-CARBOXYLATE
tert-butyl-2-(iodomethyl)-1H-pyrrole-1-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 327.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.0±3.0 kJ/mol
Flash Point: 151.8±28.4 °C
Index of Refraction: 1.563
Molar Refractivity: 64.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 2.92
ACD/BCF (pH 5.5): 97.77
ACD/KOC (pH 5.5): 925.09
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 97.77
ACD/KOC (pH 7.4): 925.09
Polar Surface Area: 31 Å2
Polarizability: 25.7±0.5 10-24cm3
Surface Tension: 39.0±7.0 dyne/cm
Molar Volume: 200.0±7.0 cm3

Click to predict properties on the Chemicalize site


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