Found 1 result

Search term: MF = 'C_{6}D_{5}NO_{2}'
ChemSpider 2D Image | Nitrobenzene-d5 | C6D5NO2

Nitrobenzene-d5

  • 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

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
Pentadeuteronitrobenzene
More...

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

1455693 [DBID]
151955_ALDRICH [DBID]
269751_ALDRICH [DBID]
308846_ALDRICH [DBID]
442718_SUPELCO [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Stability:

      Stable. Hygroscopic. Combustible. Incompatible with strongoxidizing agents, strong reducing agents, strong bases. OU Chemical Safety Data (No longer updated) More details

    • Safety:

      23/24/25-40-48/23/24-62-51/53 Alfa Aesar 42337
      28-36/37-45-61 Alfa Aesar 42337
      DANGER: POISON, severe eye, skin and lung irritant Alfa Aesar 42337
      Safety glasses, gloves, good ventilation. OU Chemical Safety Data (No longer updated) More details
  • Gas Chromatography

    • Retention Index (Lee):

      179.5 (Program type: Ramp; Column cl... (show more) ass: Semi-standard non-polar; Column diameter: 0.32 mm; Column length: 30 m; Column type: Capillary; Heat rate: 8 K/min; Start T: 40 C; End T: 285 C; End time: 29.5 min; Start time: 3 min; CAS no: 4165600; Active phase: DB-5; Carrier gas: He; Phase thickness: 0.25 um; Data type: Lee RI; Authors: Donnelly, J.R.; Abdel-Hamid, M.S.; Jeter, J.L.; Gurka, D.F., Application of gas chromatographic retention properties to the identification of environmental contaminants, J. Chromatogr., 642, 1993, 409-415.) NIST Spectra nist ri

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

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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