ChemSpider 2D Image | 2-Methoxy-4-[(1E)-2-nitro-1-buten-1-yl]phenol | C11H13NO4

2-Methoxy-4-[(1E)-2-nitro-1-buten-1-yl]phenol

  • Molecular FormulaC11H13NO4
  • Average mass223.225 Da
  • Monoisotopic mass223.084457 Da
  • ChemSpider ID62853730

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Methoxy-4-[(1E)-2-nitro-1-buten-1-yl]phenol [German] [ACD/IUPAC Name]
2-Methoxy-4-[(1E)-2-nitro-1-buten-1-yl]phenol [ACD/IUPAC Name]
2-Méthoxy-4-[(1E)-2-nitro-1-butén-1-yl]phénol [French] [ACD/IUPAC Name]
Phenol, 2-methoxy-4-[(1E)-2-nitro-1-buten-1-yl]- [ACD/Index Name]
1212-12-0 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 361.8±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 172.6±23.7 °C
Index of Refraction: 1.588
Molar Refractivity: 61.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.74
ACD/KOC (pH 5.5): 441.11
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.49
ACD/KOC (pH 7.4): 437.86
Polar Surface Area: 75 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 181.9±3.0 cm3

Click to predict properties on the Chemicalize site


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