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Search term: ZFOMKMMPBOQKMC-GUBZILKMSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N~6~-{[(2S,3S)-3-Methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine | C12H21N3O3

N6-{[(2S,3S)-3-Methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine

  • Molecular FormulaC12H21N3O3
  • Average mass255.313 Da
  • Monoisotopic mass255.158295 Da
  • ChemSpider ID35035000

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

L-Lysine, N6-[[(2S,3S)-3,4-dihydro-3-methyl-2H-pyrrol-2-yl]carbonyl]- [ACD/Index Name]
N6-{[(2S,3S)-3-Methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysin [German] [ACD/IUPAC Name]
N6-{[(2S,3S)-3-Methyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine [ACD/IUPAC Name]
N6-{[(2S,3S)-3-Méthyl-3,4-dihydro-2H-pyrrol-2-yl]carbonyl}-L-lysine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 546.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 90.3±6.0 kJ/mol
Flash Point: 284.6±30.1 °C
Index of Refraction: 1.591
Molar Refractivity: 65.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.36
ACD/LogD (pH 5.5): -3.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 194.5±7.0 cm3

Click to predict properties on the Chemicalize site


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