ChemSpider 2D Image | tert-Butyl-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)carbamat | C13H17N3O2


  • Molecular FormulaC13H17N3O2
  • Average mass247.293 Da
  • Monoisotopic mass247.132080 Da
  • ChemSpider ID21329273

More details:

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

(1H-Pyrrolo[2,3-b]pyridin-5-ylméthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(1H-Pyrrolo[2,3-b]pyridin-5-ylmethyl)-carbamic acid tert-butyl ester
1,1-Dimethylethyl N-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)carbamate
2-Methyl-2-propanyl (1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)carbamat [German] [ACD/IUPAC Name]
900514-09-2 [RN]
Carbamic acid, N-(1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
tert-butyl (1H-pyrrolo[2,3-b]pyridin-5-ylmethyl)carbamate
tert-butyl N-({1H-pyrrolo[2,3-b]pyridin-5-yl}methyl)carbamate

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

MFCD08688596 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.594
    Molar Refractivity: 70.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.49
    ACD/LogD (pH 5.5): 2.34
    ACD/BCF (pH 5.5): 34.79
    ACD/KOC (pH 5.5): 433.44
    ACD/LogD (pH 7.4): 2.37
    ACD/BCF (pH 7.4): 37.09
    ACD/KOC (pH 7.4): 462.18
    Polar Surface Area: 67 Å2
    Polarizability: 27.8±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 206.3±3.0 cm3

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