Molecular Structure of 3,4'-Dichlorodiphenyl ether (CAS NO.6842-62-2):
IUPAC Name: 1-chloro-3-(4-chlorophenoxy)benzene
Empirical Formula: C12H8Cl2O
Molecular Weight: 239.0973
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 9.23Å2
Index of Refraction: 1.594
Molar Refractivity: 62.48 cm3
Molar Volume: 183.9 cm3
Surface Tension: 42.6 dyne/cm
Density: 1.3 g/cm3
Flash Point: 109.8 °C
Enthalpy of Vaporization: 53.4 kJ/mol
Boiling Point: 314.9 °C at 760 mmHg
Vapour Pressure: 0.000836 mmHg at 25°C
InChI
InChI=1/C12H8Cl2O/c13-9-4-6-11(7-5-9)15-12-3-1-2-10(14)8-12/h1-8H
Smiles
c1c(Oc2ccc(cc2)Cl)cccc1Cl
Product Categories: Chlorobenzene Series; Biphenyl & Diphenyl ether
3,4'-Dichlorodiphenyl ether , with CAS number of 6842-62-2, can be called Ether,m-chlorophenyl p-chlorophenyl (7CI,8CI) ; benzene, 1-chloro-3-(4-chlorophenoxy)- ; 1-Chloro-3-(4-chlorophenoxy)benzene .
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