ChemSpider 2D Image | 3-(2-Amino-4-pyrimidinyl)-D-alanine | C7H10N4O2

3-(2-Amino-4-pyrimidinyl)-D-alanine

  • Molecular FormulaC7H10N4O2
  • Average mass182.180 Da
  • Monoisotopic mass182.080383 Da
  • ChemSpider ID75228896

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-(2-Amino-4-pyrimidinyl)-D-alanin [German] [ACD/IUPAC Name]
3-(2-Amino-4-pyrimidinyl)-D-alanine [ACD/IUPAC Name]
3-(2-Amino-4-pyrimidinyl)-D-alanine [French] [ACD/IUPAC Name]
4-Pyrimidinepropanoic acid, α,2-diamino-, (αR)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 472.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 239.4±31.5 °C
Index of Refraction: 1.648
Molar Refractivity: 45.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.33
ACD/LogD (pH 5.5): -3.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 115 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 87.6±3.0 dyne/cm
Molar Volume: 126.2±3.0 cm3

Click to predict properties on the Chemicalize site


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