ChemSpider 2D Image | 4-Methyl-3-nitroanisole | C8H9NO3

4-Methyl-3-nitroanisole

  • Molecular FormulaC8H9NO3
  • Average mass167.162 Da
  • Monoisotopic mass167.058243 Da
  • ChemSpider ID21111914

More details:

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

17484-36-5 [RN]
241-500-0 [EINECS]
4-Methoxy-1-methyl-2-nitrobenzene [ACD/IUPAC Name]
4-Méthoxy-1-méthyl-2-nitrobenzène [French] [ACD/IUPAC Name]
4-Methoxy-1-methyl-2-nitrobenzol [German] [ACD/IUPAC Name]
4-Methoxy-2-nitrotoluene
4-Methyl-3-nitroanisole
Benzene, 4-methoxy-1-methyl-2-nitro- [ACD/Index Name]
Methyl 4-methyl-3-nitrophenyl ether
MFCD00007173 [MDL number]
More...

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

2047309 [DBID]
139823_ALDRICH [DBID]
36579_RIEDEL [DBID]
68008_FLUKA [DBID]
CCRIS 4693 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 269.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.7±3.0 kJ/mol
Flash Point: 127.2±23.8 °C
Index of Refraction: 1.538
Molar Refractivity: 44.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 54.87
ACD/KOC (pH 5.5): 611.83
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 54.87
ACD/KOC (pH 7.4): 611.83
Polar Surface Area: 55 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 141.6±3.0 cm3

Click to predict properties on the Chemicalize site


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