ChemSpider 2D Image | Methyl N-carbamimidoyl-L-serinate | C5H11N3O3

Methyl N-carbamimidoyl-L-serinate

  • Molecular FormulaC5H11N3O3
  • Average mass161.159 Da
  • Monoisotopic mass161.080048 Da
  • ChemSpider ID24188395

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Serine, N-(aminoiminomethyl)-, methyl ester [ACD/Index Name]
Methyl N-carbamimidoyl-L-serinate [ACD/IUPAC Name]
Methyl-N-carbamimidoyl-L-serinat [German] [ACD/IUPAC Name]
N-Carbamimidoyl-L-sérinate de méthyle [French] [ACD/IUPAC Name]
(S)-methyl 2-guanidino-3-hydroxypropanoate
289705-56-2 [RN]
L-Serine, N-(aminoiminomethyl)-, methyl ester (9CI)
METHYL (2S)-2-CARBAMIMIDAMIDO-3-HYDROXYPROPANOATE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 314.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.4±6.0 kJ/mol
Flash Point: 143.8±30.7 °C
Index of Refraction: 1.548
Molar Refractivity: 35.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.80
ACD/LogD (pH 5.5): -3.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 55.8±7.0 dyne/cm
Molar Volume: 111.4±7.0 cm3

Click to predict properties on the Chemicalize site


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