ChemSpider 2D Image | (1S,2S,3S,4S,5S,6S,7S)-2,3,5,6-Tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)bicyclo[2.2.1]heptane | C10H9Cl9

(1S,2S,3S,4S,5S,6S,7S)-2,3,5,6-Tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)bicyclo[2.2.1]heptane

  • Molecular FormulaC10H9Cl9
  • Average mass448.255 Da
  • Monoisotopic mass443.790100 Da
  • ChemSpider ID34451981
  • defined stereocentres - 7 of 7 defined stereocentres


More details:






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

(1S,2S,3S,4S,5S,6S,7S)-2,3,5,6-Tetrachlor-7-(chlormethyl)-1,7-bis(dichlormethyl)bicyclo[2.2.1]heptan [German] [ACD/IUPAC Name]
(1S,2S,3S,4S,5S,6S,7S)-2,3,5,6-Tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)bicyclo[2.2.1]heptane [ACD/IUPAC Name]
(1S,2S,3S,4S,5S,6S,7S)-2,3,5,6-Tétrachloro-7-(chlorométhyl)-1,7-bis(dichlorométhyl)bicyclo[2.2.1]heptane [French] [ACD/IUPAC Name]
66860-80-8 [RN]
Bicyclo[2.2.1]heptane, 2,3,5,6-tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)-, (2S,3S,5S,6S,7S)- [ACD/Index Name]
(2S,3S,5S,6S,7S)-2,3,5,6-tetrachloro-7-(chloromethyl)-1,7-bis(dichloromethyl)norbornane
(2S,3S,5S,6S,7S)-2,3,5,6-tetrachloro-7-(chloromethyl)-4,7-bis(dichloromethyl)bicyclo[2.2.1]heptane
Toxaphene Parlar-No. 50 1 ?g/mL in Cyclohexane
Toxaphene Parlar-No. 50 1 µg/mL in Cyclohexane
Toxaphene Parlar-No. 50, ca.1 ?g/mL in Cyclohexane
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 502.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 262.8±26.1 °C
Index of Refraction: 1.575
Molar Refractivity: 87.6±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 5.86
ACD/BCF (pH 5.5): 16596.79
ACD/KOC (pH 5.5): 36498.97
ACD/LogD (pH 7.4): 5.86
ACD/BCF (pH 7.4): 16596.79
ACD/KOC (pH 7.4): 36498.97
Polar Surface Area: 0 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 265.1±5.0 cm3

Click to predict properties on the Chemicalize site






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