ChemSpider 2D Image | (2S,4R)-4-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate | C5H6NO3

(2S,4R)-4-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate

  • Molecular FormulaC5H6NO3
  • Average mass128.107 Da
  • Monoisotopic mass128.035324 Da
  • ChemSpider ID26332789

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4R)-4-Hydroxy-3,4-dihydro-2H-pyrrol-2-carboxylat [German] [ACD/IUPAC Name]
(2S,4R)-4-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate [ACD/IUPAC Name]
(2S,4R)-4-Hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate [French] [ACD/IUPAC Name]
2H-Pyrrole-2-carboxylic acid, 3,4-dihydro-4-hydroxy-, ion(1-), (2S,4R)- [ACD/Index Name]
(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylate
L-&δ;<SUP>;1</SUP>-pyrroline 3-hydroxy-5-carboxylate
L-1pyrroline-3-hydroxy-5-carboxylate
L-1-Pyrroline-3-hydroxy-5-carboxylate
L-1-pyrroline-3-hydroxy-5-carboxylate(1-)
L-δ(1)-pyrroline 3-hydroxy-5-carboxylate
  • Miscellaneous

    • Chemical Class:

      The 1-pyrrolinecarboxylate formed by deprotonation of the carboxy group of (3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid; principal microspecies at pH 7.3. ChEBI CHEBI:62612

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

Density:
Boiling Point: 399.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.2±6.0 kJ/mol
Flash Point: 195.7±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.78
ACD/LogD (pH 5.5): -3.63
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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