ChemSpider 2D Image | 4-[(1-Hydroxy-2-naphthoyl)(octadecyl)amino]phthalic acid | C37H49NO6

4-[(1-Hydroxy-2-naphthoyl)(octadecyl)amino]phthalic acid

  • Molecular FormulaC37H49NO6
  • Average mass603.788 Da
  • Monoisotopic mass603.356018 Da
  • ChemSpider ID19979337

More details:

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

1,2-Benzenedicarboxylic acid, 4-[[(1-hydroxy-2-naphthalenyl)carbonyl]octadecylamino]- [ACD/Index Name]
247-867-3 [EINECS]
4-[(1-Hydroxy-2-naphthoyl)(octadecyl)amino]phthalic acid [ACD/IUPAC Name]
4-[(1-Hydroxy-2-naphthoyl)(octadecyl)amino]phthalsäure [German] [ACD/IUPAC Name]
5-(((1-Hydroxy-2-naphthyl)carbonyl)octadecylamino)phthalic acid
Acide 4-[(1-hydroxy-2-naphtoyl)(octadécyl)amino]phtalique [French] [ACD/IUPAC Name]
26639-29-2 [RN]
5-[[(1-hydroxy-2-naphthyl)carbonyl]octadecylamino]phthalic acid

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

Density: 1.1±0.1 g/cm3
Boiling Point: 780.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 425.8±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 177.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 11.89
ACD/LogD (pH 5.5): 8.97
ACD/BCF (pH 5.5): 882984.13
ACD/KOC (pH 5.5): 110143.97
ACD/LogD (pH 7.4): 7.49
ACD/BCF (pH 7.4): 29476.49
ACD/KOC (pH 7.4): 3676.92
Polar Surface Area: 115 Å2
Polarizability: 70.5±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 525.1±3.0 cm3

Click to predict properties on the Chemicalize site


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