ChemSpider 2D Image | (6E)-6-[2-(4-Chlorophenyl)-2-oxoethylidene]-1,6-dihydro[1,2,5]oxadiazolo[3,4-b]pyrazin-5(3H)-one | C12H7ClN4O3

(6E)-6-[2-(4-Chlorophenyl)-2-oxoethylidene]-1,6-dihydro[1,2,5]oxadiazolo[3,4-b]pyrazin-5(3H)-one

  • Molecular FormulaC12H7ClN4O3
  • Average mass290.662 Da
  • Monoisotopic mass290.020660 Da
  • ChemSpider ID22949644

  • Double-bond stereo - Double-bond stereo

More details:

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

(6E)-6-[2-(4-Chlorophenyl)-2-oxoethylidene]-1,6-dihydro[1,2,5]oxadiazolo[3,4-b]pyrazin-5(3H)-one [ACD/IUPAC Name]
(6E)-6-[2-(4-Chlorophényl)-2-oxoéthylidène]-1,6-dihydro[1,2,5]oxadiazolo[3,4-b]pyrazin-5(3H)-one [French] [ACD/IUPAC Name]
(6E)-6-[2-(4-Chlorphenyl)-2-oxoethyliden]-1,6-dihydro[1,2,5]oxadiazolo[3,4-b]pyrazin-5(3H)-on [German] [ACD/IUPAC Name]
[1,2,5]Oxadiazolo[3,4-b]pyrazin-5(4H)-one, 6-[2-(4-chlorophenyl)-2-oxoethylidene]-6,7-dihydro-, (6E)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.691
Molar Refractivity: 69.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.98
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.32
ACD/KOC (pH 5.5): 267.98
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.28
ACD/KOC (pH 7.4): 267.45
Polar Surface Area: 97 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 76.8±3.0 dyne/cm
Molar Volume: 182.6±3.0 cm3

Click to predict properties on the Chemicalize site


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