ChemSpider 2D Image | 5-[(E)-(3-Chloro-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxybenzylidene)amino]-2,4(1H,3H)-pyrimidinedione | C26H30ClN3O6

5-[(E)-(3-Chloro-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxybenzylidene)amino]-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC26H30ClN3O6
  • Average mass515.986 Da
  • Monoisotopic mass515.182312 Da
  • ChemSpider ID21825828

  • Double-bond stereo - Double-bond stereo

More details:

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

2,4(1H,3H)-Pyrimidinedione, 5-[[(1E)-[3-chloro-4-[2-[4-(hexyloxy)phenoxy]ethoxy]-5-methoxyphenyl]methylene]amino]- [ACD/Index Name]
5-[(E)-(3-Chlor-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxybenzyliden)amino]-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
5-[(E)-(3-Chloro-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxybenzylidene)amino]-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
5-[(E)-(3-Chloro-4-{2-[4-(hexyloxy)phénoxy]éthoxy}-5-méthoxybenzylidène)amino]-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
5-({3-Chloro-4-[2-(4-hexyloxy-phenoxy)-ethoxy]-5-methoxy-benzylidene}-amino)-1H-pyrimidine-2,4-dione
5-{[(E)-(3-chloro-4-{2-[4-(hexyloxy)phenoxy]ethoxy}-5-methoxyphenyl)methylidene]amino}pyrimidine-2,4(1H,3H)-dione

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.579
Molar Refractivity: 135.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 5.46
ACD/BCF (pH 5.5): 8354.34
ACD/KOC (pH 5.5): 22268.02
ACD/LogD (pH 7.4): 5.31
ACD/BCF (pH 7.4): 5903.73
ACD/KOC (pH 7.4): 15736.03
Polar Surface Area: 107 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 407.3±7.0 cm3

Click to predict properties on the Chemicalize site


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