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ChemSpider 2D Image | 1455693 | C6D5NO2

1455693

  • Molecular FormulaC6D5NO2
  • Average mass128.140 Da
  • Monoisotopic mass128.063416 Da
  • ChemSpider ID109825
  • Non-standard isotope - Non-standard isotope


More details:






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

1455693
4165-60-0 [RN]
Benzene-1,2,3,4,5-d5, 6-nitro- [ACD/Index Name]
Benzene-D5-, nitro-
MFCD00044415 [MDL number]
Nitro(2H5)benzene [ACD/IUPAC Name]
Nitro(2H5)benzène [French] [ACD/IUPAC Name]
Nitro(2H5)benzol [German] [ACD/IUPAC Name]
nitro(2H5)benzene
Nitrobenzene-d5
More...

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

151955_ALDRICH [DBID]
269751_ALDRICH [DBID]
308846_ALDRICH [DBID]
442718_SUPELCO [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 210.8±0.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.9±3.0 kJ/mol
Flash Point: 87.8±0.0 °C
Index of Refraction: 1.561
Molar Refractivity: 32.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 13.89
ACD/KOC (pH 5.5): 228.85
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 13.89
ACD/KOC (pH 7.4): 228.85
Polar Surface Area: 46 Å2
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 101.3±3.0 cm3

Click to predict properties on the Chemicalize site






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