ChemSpider 2D Image | 2-Methyl-2-propanyl 3-[amino(1-methyl-5-tetrazolidinyl)methyl]-3-hydroxy-1-pyrrolidinecarboxylate | C12H26N6O3

2-Methyl-2-propanyl 3-[amino(1-methyl-5-tetrazolidinyl)methyl]-3-hydroxy-1-pyrrolidinecarboxylate

  • Molecular FormulaC12H26N6O3
  • Average mass302.373 Da
  • Monoisotopic mass302.206635 Da
  • ChemSpider ID110118028

More details:

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

1-Pyrrolidinecarboxylic acid, 3-[amino(1-methyl-5-tetrazolidinyl)methyl]-3-hydroxy-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 3-[amino(1-methyl-5-tetrazolidinyl)methyl]-3-hydroxy-1-pyrrolidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-[amino(1-methyl-5-tetrazolidinyl)methyl]-3-hydroxy-1-pyrrolidincarboxylat [German] [ACD/IUPAC Name]
3-[Amino(1-méthyl-5-tétrazolidinyl)méthyl]-3-hydroxy-1-pyrrolidinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 421.8±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±6.0 kJ/mol
Flash Point: 208.9±30.9 °C
Index of Refraction: 1.543
Molar Refractivity: 77.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.48
ACD/LogD (pH 5.5): -3.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 245.6±3.0 cm3

Click to predict properties on the Chemicalize site


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