ChemSpider 2D Image | ACPT-II | C8H11NO6

ACPT-II

  • Molecular FormulaC8H11NO6
  • Average mass217.176 Da
  • Monoisotopic mass217.058640 Da
  • ChemSpider ID23134613
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

(1R,2S,4r)-4-Amino-1,2,4-cyclopentanetricarboxylic acid [ACD/IUPAC Name]
(1R,2S,4r)-4-Amino-1,2,4-cyclopentantricarbonsäure [German] [ACD/IUPAC Name]
(1R,2S,4r)-4-Aminocyclopentane-1,2,4-tricarboxylic acid
1,2,4-Cyclopentanetricarboxylic acid, 4-amino-, (1α,2α,4α)- [ACD/Index Name]
195209-04-2 [RN]
Acide (1R,2S,4r)-4-amino-1,2,4-cyclopentanetricarboxylique [French] [ACD/IUPAC Name]
ACPT-II
(1R,2S,4R)-4-Amino-cyclopentane-1,2,4-tricarboxylic acid
(1R,3R,4S)-1-Aminocyclopentane-1,3,4-tricarboxylic acid
[195209-04-2] [RN]
More...
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      Sold with the permission of the CNRS Tocris Bioscience 1112
    • Bio Activity:

      7-TM Receptors Tocris Bioscience 1112
      Competitive metabotropic receptor antagonist (KB values are 115, 88 and 77 ?M at mGlu1a, mGlu2 and mGlu4a respectively). Tocris Bioscience 1112
      Competitive metabotropic receptor antagonist (KB values are 115, 88 and 77 muM at mGlu1a, mGlu2 and mGlu4a respectively). Tocris Bioscience 1112
      Competitive mGlu receptor antagonist Tocris Bioscience 1112
      Glutamate (Metabotropic) Receptors Tocris Bioscience 1112
      Non-selective mGlu Tocris Bioscience 1112

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

Density: 1.7±0.1 g/cm3
Boiling Point: 440.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.5±6.0 kJ/mol
Flash Point: 220.2±28.7 °C
Index of Refraction: 1.598
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.61
ACD/LogD (pH 5.5): -4.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 94.0±3.0 dyne/cm
Molar Volume: 131.5±3.0 cm3

Click to predict properties on the Chemicalize site






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