ChemSpider 2D Image | N-Carbamimidoylmethionine | C6H13N3O2S

N-Carbamimidoylmethionine

  • Molecular FormulaC6H13N3O2S
  • Average mass191.251 Da
  • Monoisotopic mass191.072845 Da
  • ChemSpider ID21473225

More details:

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

Methionine, N-(aminoiminomethyl)- [ACD/Index Name]
N-Carbamimidoylmethionin [German] [ACD/IUPAC Name]
N-Carbamimidoylmethionine [ACD/IUPAC Name]
N-Carbamimidoylméthionine [French] [ACD/IUPAC Name]
108865-64-1 [RN]
2-Carbamimidamido-4-(methylthio)butanoic acid
MFCD09998367 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 382.8±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.3±6.0 kJ/mol
Flash Point: 185.3±30.7 °C
Index of Refraction: 1.600
Molar Refractivity: 46.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.45
ACD/LogD (pH 5.5): -2.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 57.5±7.0 dyne/cm
Molar Volume: 135.6±7.0 cm3

Click to predict properties on the Chemicalize site


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