ChemSpider 2D Image | 5-{N-Benzyl-N-[6-(4-phenylbutoxy)hexyl]glycyl}-2-hydroxybenzaldehyde | C32H39NO4

5-{N-Benzyl-N-[6-(4-phenylbutoxy)hexyl]glycyl}-2-hydroxybenzaldehyde

  • Molecular FormulaC32H39NO4
  • Average mass501.656 Da
  • Monoisotopic mass501.287903 Da
  • ChemSpider ID9974271

More details:

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

163923-19-1 [RN]
5-{N-Benzyl-N-[6-(4-phenylbutoxy)hexyl]glycyl}-2-hydroxybenzaldehyd [German] [ACD/IUPAC Name]
5-{N-Benzyl-N-[6-(4-phenylbutoxy)hexyl]glycyl}-2-hydroxybenzaldehyde [ACD/IUPAC Name]
5-{N-Benzyl-N-[6-(4-phénylbutoxy)hexyl]glycyl}-2-hydroxybenzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 2-hydroxy-5-[2-[[6-(4-phenylbutoxy)hexyl](phenylmethyl)amino]acetyl]- [ACD/Index Name]
2-Hydroxy-5-[[[6-(4-phenylbutoxy)hexyl](phenylmethyl)amino]acetyl]-benzaldehyde
2-Hydroxy-5-[[[6,6-(4-phenylbutoxy)hexylbenzyl]amino]acetyl]benzaldehyde
5-(2-(Benzyl(6-(4-phenylbutoxy)hexyl)amino)acetyl)-2-hydroxybenzaldehyde
5-(2-{BENZYL[6-(4-PHENYLBUTOXY)HEXYL]AMINO}ACETYL)-2-HYDROXYBENZALDEHYDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 662.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 354.3±31.5 °C
Index of Refraction: 1.586
Molar Refractivity: 150.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 8.06
ACD/LogD (pH 5.5): 5.90
ACD/BCF (pH 5.5): 10543.64
ACD/KOC (pH 5.5): 13929.31
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 3666.59
ACD/KOC (pH 7.4): 4843.96
Polar Surface Area: 67 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 447.7±3.0 cm3

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