ChemSpider 2D Image | (2R,3R)-2,5-Diammonio-3-methylpentanoate | C6H15N2O2

(2R,3R)-2,5-Diammonio-3-methylpentanoate

  • Molecular FormulaC6H15N2O2
  • Average mass147.195 Da
  • Monoisotopic mass147.112808 Da
  • ChemSpider ID28184657

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2,5-Diammonio-3-methylpentanoat [German] [ACD/IUPAC Name]
(2R,3R)-2,5-Diammonio-3-methylpentanoate [ACD/IUPAC Name]
(2R,3R)-2,5-Diammonio-3-méthylpentanoate [French] [ACD/IUPAC Name]
D-Ornithine, 3-methyl-, inner salt, conjugate acid, (3R)- [ACD/Index Name]
(2R,3R)-2,5-diazaniumyl-3-methylpentanoate
(2R,3R)-3-methylornithine
(3R)-3-methyl-D-ornithine
(3R)-3-methyl-D-ornithine(1+)
  • Miscellaneous

    • Chemical Class:

      An amino-acid cation obtained by deprotonation of the carboxy group and protonation of the two amino groups of (3R)-3-methyl-D-ornithine; major species at pH 7.3. ChEBI CHEBI:64642

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

Density:
Boiling Point: 303.7±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 59.8±6.0 kJ/mol
Flash Point: 137.5±25.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.62
ACD/LogD (pH 5.5): -4.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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