ChemSpider 2D Image | N-[(2Z)-3-Carboxy-2-propenoyl]-L-glutamic acid | C9H11NO7

N-[(2Z)-3-Carboxy-2-propenoyl]-L-glutamic acid

  • Molecular FormulaC9H11NO7
  • Average mass245.186 Da
  • Monoisotopic mass245.053558 Da
  • ChemSpider ID23180731

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acide N-[(2Z)-3-carboxy-2-propenoyl]-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, N-[(2Z)-3-carboxy-1-oxo-2-propen-1-yl]- [ACD/Index Name]
N-[(2Z)-3-Carboxy-2-propenoyl]-L-glutamic acid [ACD/IUPAC Name]
N-[(2Z)-3-Carboxy-2-propenoyl]-L-glutaminsäure [German] [ACD/IUPAC Name]
N-[(2Z)-3-carboxyprop-2-enoyl]-L-glutamic acid
(2S)-2-[(2Z)-3-carboxyprop-2-enamido]pentanedioic acid
128135-25-1 [RN]
2-(3-Carboxy-acryloylamino)-pentanedioic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 631.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 102.0±6.0 kJ/mol
Flash Point: 335.9±31.5 °C
Index of Refraction: 1.561
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -1.74
ACD/LogD (pH 5.5): -6.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 141 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 74.8±3.0 dyne/cm
Molar Volume: 160.9±3.0 cm3

Click to predict properties on the Chemicalize site


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