ChemSpider 2D Image | m-diiodobenzene | C6H4I2

m-diiodobenzene

  • Molecular FormulaC6H4I2
  • Average mass329.905 Da
  • Monoisotopic mass329.840210 Da
  • ChemSpider ID21168837

More details:

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

1,3-Diiodbenzol [German] [ACD/IUPAC Name]
1,3-Diiodobenzene [ACD/IUPAC Name]
1,3-Diiodobenzène [French] [ACD/IUPAC Name]
210-921-1 [EINECS]
626-00-6 [RN]
Benzene, 1,3-diiodo- [ACD/Index Name]
Benzene, m-diiodo-
m-diiodobenzene
[626-00-6] [RN]
1, 3-Diiodobenzene
More...

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

MFCD00041731 [DBID]
475262_ALDRICH [DBID]
CCRIS 4693 [DBID]
e2 [DBID]
  • Experimental Physico-chemical Properties
  • Predicted Physico-chemical Properties
  • Miscellaneous
  • Gas Chromatography

    • Retention Index (Kovats):

      1489 (estimated with error: 45) NIST Spectra mainlib_15424

    • Retention Index (Normal Alkane):

      1448.3 (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: 12.5 K/min; Start T: 135 C; End T: 235 C; End time: 8.5 min; Start time: 20.5 min; CAS no: 626006; Active phase: DB-5; Carrier gas: He; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Schmidt, T.C.; Less, M.; Haas, R.; von Low, E.; Steinbach, K.; Stork, G., Gas chromatographic determination of aromatic amines in water samples after solid-phase extraction and derivatization with iodine. I. Derivatization, J. Chromatogr. A, 810, 1998, 161-172.) NIST Spectra nist ri

    • Retention Index (Linear):

      1431 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column length: 3.05 m; Column type: Packed; Heat rate: 10 K/min; Start T: 40 C; End T: 210 C; End time: 30 min; Start time: 10 min; CAS no: 626006; Active phase: SE-30; Carrier gas: He; Substrate: Chromosorb AW; Data type: Linear RI; Authors: Buchman, O.; Cao, G.-Y.; Peng, C.T., Structure assignment by retention index in gas-liquid radiochromatography of substituted cyclohexenes, J. Chromatogr., 312, 1984, 75-90.) NIST Spectra nist ri
      2161 (Program type: Ramp; Column cl... (show more) ass: Standard polar; Column length: 3.05 m; Column type: Packed; Heat rate: 10 K/min; Start T: 40 C; End T: 210 C; End time: 30 min; Start time: 10 min; CAS no: 626006; Active phase: Carbowax 20M; Carrier gas: He; Substrate: Supelcoport; Data type: Linear RI; Authors: Buchman, O.; Cao, G.-Y.; Peng, C.T., Structure assignment by retention index in gas-liquid radiochromatography of substituted cyclohexenes, J. Chromatogr., 312, 1984, 75-90.) NIST Spectra nist ri

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

Density: 2.5±0.1 g/cm3
Boiling Point: 285.7±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.4±3.0 kJ/mol
Flash Point: 145.2±15.3 °C
Index of Refraction: 1.708
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 453.97
ACD/KOC (pH 5.5): 2776.55
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 453.97
ACD/KOC (pH 7.4): 2776.55
Polar Surface Area: 0 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 133.6±3.0 cm3

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