Found 489 results

Search term: MF = 'C_{33}H_{29}N_{3}O_{5}'
ChemSpider 2D Image | 3-Benzyl-4,8-dimethyl-7-({(2E)-2-(4-methylphenyl)-2-[(4-nitrophenyl)hydrazono]ethyl}oxy)-2H-chromen-2-one | C33H29N3O5

3-Benzyl-4,8-dimethyl-7-({(2E)-2-(4-methylphenyl)-2-[(4-nitrophenyl)hydrazono]ethyl}oxy)-2H-chromen-2-one

  • Molecular FormulaC33H29N3O5
  • Average mass547.601 Da
  • Monoisotopic mass547.210693 Da
  • ChemSpider ID22931887

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-1-Benzopyran-2-one, 4,8-dimethyl-7-[[(2E)-2-(4-methylphenyl)-2-[2-(4-nitrophenyl)hydrazinylidene]ethyl]oxy]-3-(phenylmethyl)- [ACD/Index Name]
3-Benzyl-4,8-dimethyl-7-({(2E)-2-(4-methylphenyl)-2-[(4-nitrophenyl)hydrazono]ethyl}oxy)-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-Benzyl-4,8-dimethyl-7-({(2E)-2-(4-methylphenyl)-2-[(4-nitrophenyl)hydrazono]ethyl}oxy)-2H-chromen-2-one [ACD/IUPAC Name]
3-Benzyl-4,8-diméthyl-7-({(2E)-2-(4-méthylphényl)-2-[(4-nitrophényl)hydrazono]éthyl}oxy)-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 736.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 399.4±35.7 °C
Index of Refraction: 1.626
Molar Refractivity: 156.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.80
ACD/LogD (pH 5.5): 7.90
ACD/BCF (pH 5.5): 592138.44
ACD/KOC (pH 5.5): 471488.34
ACD/LogD (pH 7.4): 7.90
ACD/BCF (pH 7.4): 592139.13
ACD/KOC (pH 7.4): 471488.88
Polar Surface Area: 106 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 442.8±7.0 cm3

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