ChemSpider 2D Image | 1,1-Dimethylethyl 3-amino-6-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylate | C12H20N4O2

1,1-Dimethylethyl 3-amino-6-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylate

  • Molecular FormulaC12H20N4O2
  • Average mass252.313 Da
  • Monoisotopic mass252.158630 Da
  • ChemSpider ID24590248

More details:






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

1,1-Dimethylethyl 3-amino-6-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylate
1196153-31-7 [RN]
'1196153-31-7
MFCD10566543
tert-butyl 3-amino-6-ethyl-4,6-dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylate
TERT-BUTYL-3-AMINO-6-ETHYL-4,6-DIHYDROPYRROLO[3,4-C]PYRAZOLE-5(1H)-CARBOXYLATE

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

CCRIS 4693 [DBID]
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-08030]
    • Safety:

      20/21/22 Novochemy [NC-08030]
      20/21/36/37/39 Novochemy [NC-08030]
      GHS07; GHS09 Novochemy [NC-08030]
      H332; H403 Novochemy [NC-08030]
      P332+P313; P305+P351+P338 Novochemy [NC-08030]
      Warning Novochemy [NC-08030]
      Xn Novochemy [NC-08030]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 430.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 214.4±28.7 °C
Index of Refraction: 1.570
Molar Refractivity: 68.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.95
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 11.98
ACD/KOC (pH 5.5): 203.36
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.48
ACD/KOC (pH 7.4): 211.96
Polar Surface Area: 84 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 208.2±3.0 cm3

Click to predict properties on the Chemicalize site






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