ChemSpider 2D Image | cis-1,4-Dichlorocyclohexane | C6H10Cl2

cis-1,4-Dichlorocyclohexane

  • Molecular FormulaC6H10Cl2
  • Average mass153.050 Da
  • Monoisotopic mass152.015961 Da
  • ChemSpider ID20035164

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

cis-1,4-Dichlorcyclohexan [German] [ACD/IUPAC Name]
cis-1,4-Dichlorocyclohexane [ACD/IUPAC Name]
cis-1,4-Dichlorocyclohexane [French] [ACD/IUPAC Name]
Cyclohexane, 1,4-dichloro-, cis- [ACD/Index Name]
16749-11-4 [RN]

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

  • Gas Chromatography

    • Retention Index (Normal Alkane):

      1084 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column diameter: 0.20 mm; Column length: 25 m; Column type: Capillary; Heat rate: 6 K/min; Start T: 60 C; End T: 240 C; CAS no: 16749114; Active phase: OV-101; Carrier gas: Nitrogen; Phase thickness: 0.25 um; Data type: Normal alkane RI; Authors: Zenkevich, I.G.; Eliseenkov, E.V.; Kasatochkin, A.N., Chromatographic Identification of Cyclohexane Chlorination Products by an Additive Scheme for the Prediction of Retention Indices, Chromatographia, 70(5/6), 2009, 839-849.) NIST Spectra nist ri
      1106.3 (Program type: Ramp; Column cl... (show more) ass: Standard non-polar; Column diameter: 0.2 mm; Column length: 50 m; Column type: Capillary; Heat rate: 2 K/min; Start T: 20 C; End T: 200 C; Start time: 5 min; CAS no: 16749114; Active phase: Methyl Silicone; Carrier gas: N2; Data type: Normal alkane RI; Authors: Yasuhara, A.; Morita, M.; Fuwa, K., Temperature-programmed retention indices of 221 halogenated organic compounds with 1-bromoalkanes as references, J. Chromatogr., 328, 1985, 35-48.) NIST Spectra nist ri

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

Density: 1.1±0.1 g/cm3
Boiling Point: 204.1±15.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.2±3.0 kJ/mol
Flash Point: 80.4±13.9 °C
Index of Refraction: 1.473
Molar Refractivity: 37.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 107.50
ACD/KOC (pH 5.5): 990.14
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 107.50
ACD/KOC (pH 7.4): 990.14
Polar Surface Area: 0 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 30.9±5.0 dyne/cm
Molar Volume: 133.4±5.0 cm3

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