ChemSpider 2D Image | (4R)-4-{3-[Hydroxy(methyl)amino]-3-oxopropyl}-L-glutamic acid | C9H16N2O6

(4R)-4-{3-[Hydroxy(methyl)amino]-3-oxopropyl}-L-glutamic acid

  • Molecular FormulaC9H16N2O6
  • Average mass248.233 Da
  • Monoisotopic mass248.100830 Da
  • ChemSpider ID29396989

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-4-{3-[Hydroxy(methyl)amino]-3-oxopropyl}-L-glutamic acid [ACD/IUPAC Name]
(4R)-4-{3-[Hydroxy(methyl)amino]-3-oxopropyl}-L-glutaminsäure [German] [ACD/IUPAC Name]
Acide (4R)-4-{3-[hydroxy(méthyl)amino]-3-oxopropyl}-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, 4-[3-(hydroxymethylamino)-3-oxopropyl]-, (4R)- [ACD/Index Name]
3ZA

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

Density: 1.4±0.1 g/cm3
Boiling Point: 494.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 87.8±6.0 kJ/mol
Flash Point: 253.1±31.5 °C
Index of Refraction: 1.557
Molar Refractivity: 55.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -2.21
ACD/LogD (pH 5.5): -5.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 73.2±3.0 dyne/cm
Molar Volume: 172.7±3.0 cm3

Click to predict properties on the Chemicalize site


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