ChemSpider 2D Image | trans-3-Aminocyclobutanecarboxylic acid | C5H9NO2

trans-3-Aminocyclobutanecarboxylic acid

  • Molecular FormulaC5H9NO2
  • Average mass115.131 Da
  • Monoisotopic mass115.063332 Da
  • ChemSpider ID23347183
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

74307-75-8 [RN]
Acide trans-3-aminocyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 3-amino-, trans- [ACD/Index Name]
trans-3-Aminocyclobutancarbonsäure [German] [ACD/IUPAC Name]
trans-3-Aminocyclobutanecarboxylic acid [ACD/IUPAC Name]
trans-3-Amino-cyclobutanecarboxylic acid
(1r,3r)-3-aminocyclobutane-1-carboxylic acid
(1r,3r)-3-Aminocyclobutanecarboxylic acid
[74307-75-8] [RN]
BR-39357
More...

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

CCRIS 4693 [DBID]
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-06894]
    • Safety:

      20/21/22 Novochemy [NC-06894]
      20/21/36/37/39 Novochemy [NC-06894]
      GHS07; GHS09 Novochemy [NC-06894]
      H332; H403 Novochemy [NC-06894]
      IRRITANT Matrix Scientific 068588
      P309+P311; P211; P242 Novochemy [NC-06894]
      Warning Novochemy [NC-06894]
      Xn Novochemy [NC-06894]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 251.0±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 53.8±6.0 kJ/mol
Flash Point: 105.6±25.4 °C
Index of Refraction: 1.531
Molar Refractivity: 28.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -3.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 90.8±3.0 cm3

Click to predict properties on the Chemicalize site






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