ChemSpider 2D Image | Benzyl 4,7-diazaspiro[2.5]octane-4-carboxylate | C14H18N2O2

Benzyl 4,7-diazaspiro[2.5]octane-4-carboxylate

  • Molecular FormulaC14H18N2O2
  • Average mass246.305 Da
  • Monoisotopic mass246.136826 Da
  • ChemSpider ID23078446

More details:

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

4,7-Diazaspiro[2.5]octane-4-carboxylate de benzyle [French] [ACD/IUPAC Name]
4,7-Diazaspiro[2.5]octane-4-carboxylic acid phenylmethyl ester
4,7-Diazaspiro[2.5]octane-4-carboxylic acid, phenylmethyl ester [ACD/Index Name]
787564-07-2 [RN]
Benzyl 4,7-diazaspiro[2.5]octane-4-carboxylate [ACD/IUPAC Name]
Benzyl-4,7-diazaspiro[2.5]octan-4-carboxylat [German] [ACD/IUPAC Name]
4,7-Diazaspiro[2.5]octane-4-carboxylic acid benzyl ester
4,7-Diaza-spiro[2.5]octane-4-carboxylic acid benzyl ester

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

  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-15416]
    • Safety:

      20/21/22 Novochemy [NC-15416]
      20/21/36/37/39 Novochemy [NC-15416]
      GHS07; GHS09 Novochemy [NC-15416]
      H332; H403 Novochemy [NC-15416]
      P332+P313; P305+P351+P338 Novochemy [NC-15416]
      Warning Novochemy [NC-15416]
      Xn Novochemy [NC-15416]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 391.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 190.7±24.6 °C
Index of Refraction: 1.601
Molar Refractivity: 69.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): -1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.28
Polar Surface Area: 42 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 51.9±5.0 dyne/cm
Molar Volume: 201.8±5.0 cm3

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