ChemSpider 2D Image | tert-Butyl 6-(bromomethyl)-1H-indazole-1-carboxylate | C13H15BrN2O2

tert-Butyl 6-(bromomethyl)-1H-indazole-1-carboxylate

  • Molecular FormulaC13H15BrN2O2
  • Average mass311.174 Da
  • Monoisotopic mass310.031677 Da
  • ChemSpider ID32058435

More details:

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

1126424-54-1 [RN]
1H-Indazole-1-carboxylic acid, 6-(bromomethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 6-(bromomethyl)-1H-indazole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-6-(brommethyl)-1H-indazol-1-carboxylat [German] [ACD/IUPAC Name]
6-(Bromométhyl)-1H-indazole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 6-(bromomethyl)-1H-indazole-1-carboxylate
MFCD21364527
TERT-BUTYL 6-(BROMOMETHYL)INDAZOLE-1-CARBOXYLATE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 400.3±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 195.9±26.5 °C
Index of Refraction: 1.591
Molar Refractivity: 74.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 189.12
ACD/KOC (pH 5.5): 1483.52
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 189.12
ACD/KOC (pH 7.4): 1483.52
Polar Surface Area: 44 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 42.8±7.0 dyne/cm
Molar Volume: 219.5±7.0 cm3

Click to predict properties on the Chemicalize site


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