Chemical Properties of 1,1'-Biphenyl 2,3'-dichloro- (CAS 25569-80-6)

InChI

InChI=1S/C12H8Cl2/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)14/h1-8H

InChI Key

ZHBBDTRJIVXKEX-UHFFFAOYSA-N

Formula

C12H8Cl2

SMILES

Clc1cccc(-c2ccccc2Cl)c1

Molecular Weight¹

223.10

CAS

25569-80-6

Other Names

• 2,3'-Dichloro-1,1'-biphenyl
• 2,3'-Dichlorobiphenyl
• PCB 6

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	136.84	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.53	kJ/mol	Joback Calculated Property
ΔvapH°	76.97	kJ/mol	Relay (1.0) Calculated Property
IE	8.33	eV	Relay (1.0) Calculated Property
log10WS	-5.49		Relay (1.0) Calculated Property
logPoct/wat	4.660		Crippen Calculated Property
McVol	156.900	ml/mol	McGowan Calculated Property
Inp	[1644.00; 1690.00]
Inp	1689.00		NIST
Inp	1655.00		NIST
Inp	1658.00		NIST
Inp	1690.00		NIST
Inp	1648.90		NIST
Inp	1649.00		NIST
Inp	1676.00		NIST
Inp	1644.00		NIST
Inp	1649.00		NIST
Inp	1648.90		NIST
Inp	1689.00		NIST
Tboil	577.45	K	Relay (1.0) Calculated Property
Tfus	298.43	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[328.13; 391.65]	J/mol×K	[612.34; 872.17]
Cp,gas	328.13	J/mol×K	612.34	Joback Calculated Property
Cp,gas	341.30	J/mol×K	655.64	Joback Calculated Property
Cp,gas	353.34	J/mol×K	698.95	Joback Calculated Property
Cp,gas	364.32	J/mol×K	742.25	Joback Calculated Property
Cp,gas	374.32	J/mol×K	785.56	Joback Calculated Property
Cp,gas	383.40	J/mol×K	828.86	Joback Calculated Property
Cp,gas	391.65	J/mol×K	872.17	Joback Calculated Property
η	[0.0001961; 0.0013975]	Pa×s	[362.72; 612.34]
η	0.0013975	Pa×s	362.72	Joback Calculated Property
η	0.0008513	Pa×s	404.32	Joback Calculated Property
η	0.0005688	Pa×s	445.93	Joback Calculated Property
η	0.0004071	Pa×s	487.53	Joback Calculated Property
η	0.0003072	Pa×s	529.13	Joback Calculated Property
η	0.0002414	Pa×s	570.74	Joback Calculated Property
η	0.0001961	Pa×s	612.34	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,1'-Biphenyl 2,3'-dichloro-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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