ChemSpider 2D Image | 7-(tert-butoxycarbonyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylic acid | C12H18N2O5

7-(tert-butoxycarbonyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylic acid

  • Molecular FormulaC12H18N2O5
  • Average mass270.282 Da
  • Monoisotopic mass270.121582 Da
  • ChemSpider ID24599315

More details:






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

1-Oxa-2,7-diazaspiro[4.4]non-2-ene-3,7-dicarboxylic acid, 7-(1,1-dimethylethyl) ester [ACD/Index Name]
7-(tert-butoxycarbonyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylic acid
7-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-oxa-2,7-diazaspiro[4.4]non-2-en-3-carbonsäure [German] [ACD/IUPAC Name]
7-{[(2-Methyl-2-propanyl)oxy]carbonyl}-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylic acid [ACD/IUPAC Name]
Acide 7-{[(2-méthyl-2-propanyl)oxy]carbonyl}-1-oxa-2,7-diazaspiro[4.4]non-2-ène-3-carboxylique [French] [ACD/IUPAC Name]
[1160247-02-8]
1160247-02-8 [RN]
1-Oxa-2,7-diaza-spiro[4.4]non-2-ene-3,7-dicarboxylic acid 7-tert-butyl ester
1-oxa-2,7-diaza-spiro4.4non-2-ene-3,7-dicarboxylic acid 7-tert-butyl ester
7-(t-Butoxycarbonyl)-1-oxa-2,7-diazaspiro[4.4]non-2-ene-3-carboxylic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 409.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 72.6±6.0 kJ/mol
Flash Point: 201.7±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 65.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.24
ACD/LogD (pH 5.5): -1.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 88 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 197.3±7.0 cm3

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