ChemSpider 2D Image | Chrysene-d12 | C18D12

Chrysene-d12

  • Molecular FormulaC18D12
  • Average mass240.362 Da
  • Monoisotopic mass240.169220 Da
  • ChemSpider ID2340889

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H12)Chrysen [German] [ACD/IUPAC Name]
(2H12)Chrysene [ACD/IUPAC Name]
(2H12)Chrysène [French] [ACD/IUPAC Name]
1719-03-5 [RN]
Chrysene-d12 [ACD/Index Name]
Chrysene-d12
MFCD00134283
1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriochrysene
Benzo[a]phenanthrene
Chrysene D12
More...

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

364614_ALDRICH [DBID]
442523_SUPELCO [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Appearance:

      white flaky solid OU Chemical Safety Data (No longer updated) More details

    • Stability:

      Stable. Combustible. Incompatible with strongoxidizing agents. Protect from moisture. OU Chemical Safety Data (No longer updated) More details

    • Safety:

      Safety glasses, gloves, good ventilation.Handle as a carcinogen. OU Chemical Safety Data (No longer updated) More details
  • Gas Chromatography

    • Retention Index (Normal Alkane):

      2437.4 (Program type: Complex; Column... (show more) class: Semi-standard non-polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Description: 70C(2min) =>25C/min =>150C=>3C/min => 200C=> 8C/min =>280C(10min); CAS no: 1719035; Active phase: HP-5MS; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Wong, J.W.; Webster, M.G.; Bezabeh, D.Z.; Hengel, M.J.; Ngim, K.K.; Krynitsky, A.J.; Ebeler, S.E., Multiresidue determination of pesticides in malt beverages by capillary gas chromatography with mass spectrometry and selected ion monitoring, J. Agric. Food Chem., 52, 2004, 6361-6372.) NIST Spectra nist ri
      2468 (Program type: Complex; Column... (show more) class: Semi-standard non-polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Description: 50 0C (3 min) ^ 25 0C/min -> 125 0C ^ 10 0C/min -> 275 0C (25 min); CAS no: 1719035; Active phase: HP-5; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Lehotay, S.J., Analysis of pesticide residues in mixed fruit and vegetable extracts by direct sample introduction/gas chromatography/tandem mass spectrometry, J. AOAC Int., 83(3), 2000, 680-697.) NIST Spectra nist ri
      2442.7 (Program type: Ramp; Column cl... (show more) ass: Semi-standard non-polar; Column diameter: 0.25 mm; Column length: 30 m; Column type: Capillary; Heat rate: 6 K/min; Start T: 60 C; End T: 260 C; End time: 12 min; CAS no: 1719035; Active phase: DB-5; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Mogadati, P.; Louis, J.B.; Rosen, J.D., Multiresidue determination of pesticides in high-organic-content soils by solid-phase extraction and gas chromatography/mass spectrometry, J. AOAC Int., 82(3), 1999, 705-715.) 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: 448.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 67.9±0.8 kJ/mol
Flash Point: 209.1±13.7 °C
Index of Refraction: 1.771
Molar Refractivity: 79.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 1
ACD/LogP: 5.91
ACD/LogD (pH 5.5): 5.71
ACD/BCF (pH 5.5): 12816.21
ACD/KOC (pH 5.5): 30333.51
ACD/LogD (pH 7.4): 5.71
ACD/BCF (pH 7.4): 12816.21
ACD/KOC (pH 7.4): 30333.51
Polar Surface Area: 0 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 53.5±3.0 dyne/cm
Molar Volume: 191.8±3.0 cm3

Click to predict properties on the Chemicalize site


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