Found 1 result

Search term: FZVMEHZXVUBQBH-FSJBWODESA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 2-(5,7-Dimethyl-benzooxazol-2-yl)-4-[(4-nitro-benzylidene)-amino]-phenol | C22H17N3O4

2-(5,7-Dimethyl-benzooxazol-2-yl)-4-[(4-nitro-benzylidene)-amino]-phenol

  • Molecular FormulaC22H17N3O4
  • Average mass387.388 Da
  • Monoisotopic mass387.121918 Da
  • ChemSpider ID17725669
  • Double-bond stereo - Double-bond stereo


More details:






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

2-(5,7-Dimethyl-1,3-benzoxazol-2-yl)-4-[(E)-(4-nitrobenzyliden)amino]phenol [German] [ACD/IUPAC Name]
2-(5,7-Dimethyl-1,3-benzoxazol-2-yl)-4-[(E)-(4-nitrobenzylidene)amino]phenol [ACD/IUPAC Name]
2-(5,7-Diméthyl-1,3-benzoxazol-2-yl)-4-[(E)-(4-nitrobenzylidène)amino]phénol [French] [ACD/IUPAC Name]
2-(5,7-Dimethyl-benzooxazol-2-yl)-4-[(4-nitro-benzylidene)-amino]-phenol
Phenol, 2-(5,7-dimethyl-2-benzoxazolyl)-4-[[(1E)-(4-nitrophenyl)methylene]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 604.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.2±3.0 kJ/mol
Flash Point: 319.3±31.5 °C
Index of Refraction: 1.665
Molar Refractivity: 107.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.02
ACD/LogD (pH 5.5): 4.76
ACD/BCF (pH 5.5): 2410.78
ACD/KOC (pH 5.5): 9122.08
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1005.14
ACD/KOC (pH 7.4): 3803.30
Polar Surface Area: 104 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 52.7±7.0 dyne/cm
Molar Volume: 289.3±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement