ChemSpider 2D Image | tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate | C11H17NO3

tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate

  • Molecular FormulaC11H17NO3
  • Average mass211.258 Da
  • Monoisotopic mass211.120850 Da
  • ChemSpider ID24534450

More details:






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

1181816-12-5 [RN]
MFCD15071430 [MDL number]
tert-butyl 6-oxo-2-azaspiro[3.3]heptane-2-carboxylate
[1181816-12-5] [RN]
1-(6H-phenanthridin-5-yl)ethanone
1147557-97-8 [RN]
118181-61-6 [RN]
2-Boc-6-Oxo-2-azaspiro[3.3]heptane
2-Boc-6-oxo-2-azaspiro[3.4]octane
2-Methyl-2-propanyl6-oxo-2-azaspiro[3.3]heptane-2-carboxylate
More...

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-06852]
    • Safety:

      20/21/22 Novochemy [NC-06852]
      20/21/36/37/39 Novochemy [NC-06852]
      GHS07; GHS09 Novochemy [NC-06852]
      H332; H403 Novochemy [NC-06852]
      Harmful/Irritant/Keep Cold SynQuest 4H56-1-QT
      IRRITANT Matrix Scientific 070594
      P301+P310; P337+P313 Novochemy [NC-06852]
      Warning Novochemy [NC-06852]
      Xn Novochemy [NC-06852]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 314.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 144.1±27.9 °C
Index of Refraction: 1.518
Molar Refractivity: 54.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.45
ACD/LogD (pH 5.5): 0.83
ACD/BCF (pH 5.5): 2.51
ACD/KOC (pH 5.5): 67.31
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.51
ACD/KOC (pH 7.4): 67.31
Polar Surface Area: 47 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 180.8±5.0 cm3

Click to predict properties on the Chemicalize site






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