ChemSpider 2D Image | Benzyl 3-(aminomethyl)-1-azetidinecarboxylate | C12H16N2O2

Benzyl 3-(aminomethyl)-1-azetidinecarboxylate

  • Molecular FormulaC12H16N2O2
  • Average mass220.268 Da
  • Monoisotopic mass220.121185 Da
  • ChemSpider ID24011969

More details:






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

1-Azetidinecarboxylic acid, 3-(aminomethyl)-, phenylmethyl ester [ACD/Index Name]
3-(Aminométhyl)-1-azétidinecarboxylate de benzyle [French] [ACD/IUPAC Name]
Benzyl 3-(aminomethyl)-1-azetidinecarboxylate [ACD/IUPAC Name]
Benzyl-3-(aminomethyl)-1-azetidincarboxylat [German] [ACD/IUPAC Name]
1016731-24-0 [RN]
112257-20-2 [RN]
12257-20-2 [RN]
1-cbz-3-(aminomethyl)-azetidine
1-Cbz-3-(aminomethyl)azetidine
1-Cbz-3-aminoazetidine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 355.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 168.6±23.2 °C
Index of Refraction: 1.574
Molar Refractivity: 61.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.68
ACD/LogD (pH 5.5): -2.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 56 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 185.1±3.0 cm3

Click to predict properties on the Chemicalize site






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