ChemSpider 2D Image | (3S,4S)-3-(Carboxymethyl)-4-(1,1-~3~H_2_)-1-propen-2-yl-L-proline | C10H13T2NO4

(3S,4S)-3-(Carboxymethyl)-4-(1,1-3H2)-1-propen-2-yl-L-proline

  • Molecular FormulaC10H13T2NO4
  • Average mass217.247 Da
  • Monoisotopic mass217.116562 Da
  • ChemSpider ID9239026

  • defined stereocentres - 3 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3S,4S)-3-(Carboxymethyl)-4-(1,1-3H2)-1-propen-2-yl-L-prolin [German] [ACD/IUPAC Name]
(3S,4S)-3-(Carboxymethyl)-4-(1,1-3H2)-1-propen-2-yl-L-proline [ACD/IUPAC Name]
(3S,4S)-3-(Carboxyméthyl)-4-(1,1-3H2)-1-propén-2-yl-L-proline [French] [ACD/IUPAC Name]
L-Proline, 3-(carboxymethyl)-4-(1-methylethenyl-2,2-t2)-, (3S,4S)- [ACD/Index Name]

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

Density:
Boiling Point: 439.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±6.0 kJ/mol
Flash Point: 219.8±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.50
ACD/LogD (pH 5.5): -2.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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