ChemSpider 2D Image | 7-N-Boc-Amino-indole | C13H16N2O2


  • Molecular FormulaC13H16N2O2
  • Average mass232.278 Da
  • Monoisotopic mass232.121185 Da
  • ChemSpider ID21373643

More details:

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

1,1-Dimethylethyl N-1H-indol-7-ylcarbamate
1H-Indol-7-ylcarbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 1H-indol-7-ylcarbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-1H-indol-7-ylcarbamat [German] [ACD/IUPAC Name]
886365-44-2 [RN]
Carbamic acid, N-1H-indol-7-yl-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-Butyl 1H-indol-7-ylcarbamate
(1H-Indol-7-yl)carbamic acid tert-butyl ester
(1H-Indol-7-yl)-carbamic acid tert-butyl ester

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

  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-16361]
    • Safety:

      20/21/22 Novochemy [NC-16361]
      20/21/36/37/39 Novochemy [NC-16361]
      GHS07; GHS09 Novochemy [NC-16361]
      H332; H403 Novochemy [NC-16361]
      P301+P310; P337+P313 Novochemy [NC-16361]
      Warning Novochemy [NC-16361]
      Xn Novochemy [NC-16361]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 350.4±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.5±3.0 kJ/mol
Flash Point: 165.7±20.4 °C
Index of Refraction: 1.636
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 113.73
ACD/KOC (pH 5.5): 1030.74
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 113.77
ACD/KOC (pH 7.4): 1031.14
Polar Surface Area: 54 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 190.9±3.0 cm3

Click to predict properties on the Chemicalize site