ChemSpider 2D Image | 1,2,3-Trimethoxy-5-[(1E)-2-nitro-1-buten-1-yl]benzene | C13H17NO5

1,2,3-Trimethoxy-5-[(1E)-2-nitro-1-buten-1-yl]benzene

  • Molecular FormulaC13H17NO5
  • Average mass267.278 Da
  • Monoisotopic mass267.110687 Da
  • ChemSpider ID23552971

  • Double-bond stereo - Double-bond stereo

More details:

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

1,2,3-Trimethoxy-5-[(1E)-2-nitro-1-buten-1-yl]benzene [ACD/IUPAC Name]
1,2,3-Triméthoxy-5-[(1E)-2-nitro-1-butén-1-yl]benzène [French] [ACD/IUPAC Name]
1,2,3-Trimethoxy-5-[(1E)-2-nitro-1-buten-1-yl]benzol [German] [ACD/IUPAC Name]
Benzene, 1,2,3-trimethoxy-5-[(1E)-2-nitro-1-buten-1-yl]- [ACD/Index Name]

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

Density: 1.2±0.0 g/cm3
Boiling Point: 392.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 61.7±0.0 kJ/mol
Flash Point: 162.4±0.0 °C
Index of Refraction: 1.540
Molar Refractivity: 72.7±0.0 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 81.50
ACD/KOC (pH 5.5): 812.12
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 81.50
ACD/KOC (pH 7.4): 812.12
Polar Surface Area: 74 Å2
Polarizability: 28.8±0.0 10-24cm3
Surface Tension: 38.0±0.0 dyne/cm
Molar Volume: 231.5±0.0 cm3

Click to predict properties on the Chemicalize site


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