ChemSpider 2D Image | (2R)-2-[(2-Carboxylatoethyl)ammonio]propanoate | C6H10NO4

(2R)-2-[(2-Carboxylatoethyl)ammonio]propanoate

  • Molecular FormulaC6H10NO4
  • Average mass160.148 Da
  • Monoisotopic mass160.061523 Da
  • ChemSpider ID26331383

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-[(2-Carboxylatoethyl)ammonio]propanoat [German] [ACD/IUPAC Name]
(2R)-2-[(2-Carboxylatoethyl)ammonio]propanoate [ACD/IUPAC Name]
(2R)-2-[(2-Carboxylatoéthyl)ammonio]propanoate [French] [ACD/IUPAC Name]
D-Alanine, N-(2-carboxyethyl)-, inner salt, ion(1-) [ACD/Index Name]
(2R)-2-[(2-carboxylatoethyl)azaniumyl]propanoate
(R)-β-alanopine
(R)-β-alanopine anion
(R)-β-alanopine(1-)

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

Density:
Boiling Point: 366.9±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 67.4±6.0 kJ/mol
Flash Point: 175.7±23.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.30
ACD/LogD (pH 5.5): -4.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 97 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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