ChemSpider 2D Image | 2-(4-tert-Butylphenyl)-N-{(E)-[4-(2,4-dinitrophenoxy)phenyl]methylene}-1,3-benzoxazol-5-amine | C30H24N4O6

2-(4-tert-Butylphenyl)-N-{(E)-[4-(2,4-dinitrophenoxy)phenyl]methylene}-1,3-benzoxazol-5-amine

  • Molecular FormulaC30H24N4O6
  • Average mass536.535 Da
  • Monoisotopic mass536.169556 Da
  • ChemSpider ID3166680

  • Double-bond stereo - Double-bond stereo

More details:

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

(E)-1-[4-(2,4-Dinitrophenoxy)phenyl]-N-{2-[4-(2-methyl-2-propanyl)phenyl]-1,3-benzoxazol-5-yl}methanimin [German] [ACD/IUPAC Name]
(E)-1-[4-(2,4-Dinitrophenoxy)phenyl]-N-{2-[4-(2-methyl-2-propanyl)phenyl]-1,3-benzoxazol-5-yl}methanimine [ACD/IUPAC Name]
(E)-1-[4-(2,4-Dinitrophénoxy)phényl]-N-{2-[4-(2-méthyl-2-propanyl)phényl]-1,3-benzoxazol-5-yl}méthanimine [French] [ACD/IUPAC Name]
2-(4-tert-Butylphenyl)-N-{(E)-[4-(2,4-dinitrophenoxy)phenyl]methylene}-1,3-benzoxazol-5-amine
5-Benzoxazolamine, 2-[4-(1,1-dimethylethyl)phenyl]-N-[(1E)-[4-(2,4-dinitrophenoxy)phenyl]methylene]- [ACD/Index Name]
[2-(4-tert-Butyl-phenyl)-benzooxazol-5-yl]-[4-(2,4-dinitro-phenoxy)-benzylidene]-amine
1-[4-((1E)-2-{2-[4-(tert-butyl)phenyl]benzoxazol-5-yl}-2-azavinyl)phenoxy]-2,4-dinitrobenzene
2-(4-tert-butylphenyl)-N-{(E)-[4-(2,4-dinitrophenoxy)phenyl]methylidene}-1,3-benzoxazol-5-amine

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

A0352/0016240 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 638.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 339.8±31.5 °C
Index of Refraction: 1.647
Molar Refractivity: 148.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 7.64
ACD/LogD (pH 5.5): 6.29
ACD/BCF (pH 5.5): 28506.23
ACD/KOC (pH 5.5): 41617.46
ACD/LogD (pH 7.4): 6.67
ACD/BCF (pH 7.4): 68879.27
ACD/KOC (pH 7.4): 100559.77
Polar Surface Area: 139 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 52.8±7.0 dyne/cm
Molar Volume: 408.0±7.0 cm3

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