ChemSpider 2D Image | Diethyl (1R,2S,4E)-4-{[3-(4-hydroxy-2-oxo-1(2H)-pyrimidinyl)propanoyl]hydrazono}-1,2-cyclopentanedicarboxylate | C18H24N4O7

Diethyl (1R,2S,4E)-4-{[3-(4-hydroxy-2-oxo-1(2H)-pyrimidinyl)propanoyl]hydrazono}-1,2-cyclopentanedicarboxylate

  • Molecular FormulaC18H24N4O7
  • Average mass408.406 Da
  • Monoisotopic mass408.164490 Da
  • ChemSpider ID58918615

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S,4E)-4-{[3-(4-Hydroxy-2-oxo-1(2H)-pyrimidinyl)propanoyl]hydrazono}-1,2-cyclopentanedicarboxylate de diéthyle [French] [ACD/IUPAC Name]
1,2-Cyclopentanedicarboxylic acid, 4-[2-[3-(4-hydroxy-2-oxo-1(2H)-pyrimidinyl)-1-oxopropyl]hydrazinylidene]-, diethyl ester, (1R,2S,4E)- [ACD/Index Name]
Diethyl (1R,2S,4E)-4-{[3-(4-hydroxy-2-oxo-1(2H)-pyrimidinyl)propanoyl]hydrazono}-1,2-cyclopentanedicarboxylate [ACD/IUPAC Name]
Diethyl-(1R,2S,4E)-4-{[3-(4-hydroxy-2-oxo-1(2H)-pyrimidinyl)propanoyl]hydrazono}-1,2-cyclopentandicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 100.2±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -3.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 39.7±0.5 10-24cm3
Surface Tension: 55.3±7.0 dyne/cm
Molar Volume: 287.8±7.0 cm3

Click to predict properties on the Chemicalize site


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