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Search term: ITRGOTBZFYOSQQ-XYULLFFJCR (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-({[6-(Benzoylamino)hexanoyl]hydrazono}methyl)phenyl 4-nitrobenzoate | C27H26N4O6

3-({[6-(Benzoylamino)hexanoyl]hydrazono}methyl)phenyl 4-nitrobenzoate

  • Molecular FormulaC27H26N4O6
  • Average mass502.518 Da
  • Monoisotopic mass502.185242 Da
  • ChemSpider ID3687596

More details:






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

3-({[6-(Benzoylamino)hexanoyl]hydrazono}methyl)phenyl 4-nitrobenzoate [ACD/IUPAC Name]
3-({[6-(Benzoylamino)hexanoyl]hydrazono}methyl)phenyl-4-nitrobenzoat [German] [ACD/IUPAC Name]
4-Nitrobenzoate de 3-({[6-(benzoylamino)hexanoyl]hydrazono}méthyl)phényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-nitro-, 3-[[2-[6-(benzoylamino)-1-oxohexyl]hydrazinylidene]methyl]phenyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.609
Molar Refractivity: 138.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 4.57
ACD/BCF (pH 5.5): 1758.08
ACD/KOC (pH 5.5): 7318.06
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1758.08
ACD/KOC (pH 7.4): 7318.06
Polar Surface Area: 143 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 398.9±7.0 cm3

Click to predict properties on the Chemicalize site


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