Chemical Properties of Benzene, 1,1'-sulfonylbis[4-chloro- (CAS 80-07-9)

InChI

InChI=1S/C12H8Cl2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H

InChI Key

GPAPPPVRLPGFEQ-UHFFFAOYSA-N

Formula

C12H8Cl2O2S

SMILES

O=S(=O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

Molecular Weight¹

287.16

CAS

80-07-9

Other Names

• Sulfone, bis(p-chlorophenyl)
• p,p'-Dichlorodiphenyl sulfone
• Bis(p-chlorophenyl) sulfone
• Bis(4-chlorophenyl) sulfone
• 4-Chloro-1-(4-chlorophenylsulfonyl)benzene
• 4-Chlorophenyl sulfone
• 4,4'-Dichlorodiphenyl sulfone
• p-Chlorophenyl sulfone
• 4,4'-Dichlorodiphenyl sulphone
• Bis(4-chlorophenyl)sulphone
• 1,1'-Sulfonylbis(4-chlorobenzene)
• Di-p-chlorophenyl sulfone
• NSC 23899
• 1-Chloro-4-[(4-chlorophenyl)sulfonyl]benzene
• 85228-26-8

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,solid : Solid phase heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_{solid,1 bar} : Solid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-236.68	kJ/mol	Joback Calculated Property
ΔfH°gas	-325.72	kJ/mol	Joback Calculated Property
ΔfusH°	33.91	kJ/mol	Joback Calculated Property
ΔvapH°	75.59	kJ/mol	Joback Calculated Property
log10WS	-4.21		Crippen Calculated Property
logPoct/wat	3.826		Crippen Calculated Property
McVol	184.990	ml/mol	McGowan Calculated Property
Pc	3642.13	kPa	Joback Calculated Property
Inp	[2248.00; 2270.00]
Inp	2270.00		NIST
Inp	2248.00		NIST
Inp	2248.00		NIST
Inp	2270.00		NIST
S°solid,1 bar	314.20	J/mol×K	NIST
Tboil	659.92	K	Joback Calculated Property
Tc	906.63	K	Joback Calculated Property
Tfus	421.90 ± 3.00	K	NIST
Ttriple	422.00 ± 2.00	K	NIST
Vc	0.716	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[408.35; 468.18]	J/mol×K	[659.92; 906.63]
Cp,gas	408.35	J/mol×K	659.92	Joback Calculated Property
Cp,gas	421.14	J/mol×K	701.04	Joback Calculated Property
Cp,gas	432.76	J/mol×K	742.16	Joback Calculated Property
Cp,gas	443.24	J/mol×K	783.27	Joback Calculated Property
Cp,gas	452.61	J/mol×K	824.39	Joback Calculated Property
Cp,gas	460.91	J/mol×K	865.51	Joback Calculated Property
Cp,gas	468.18	J/mol×K	906.63	Joback Calculated Property
Cp,solid	269.30	J/mol×K	298.15	NIST
ΔfusH	[24.40; 24.40]	kJ/mol	[422.00; 422.00]
ΔfusH	24.40	kJ/mol	422.00	NIST
ΔfusH	24.40	kJ/mol	422.00	NIST
ΔfusH	24.40	kJ/mol	422.00	NIST
ΔvapH	59.70	kJ/mol	518.00	NIST
ΔfusS	57.80	J/mol×K	422.00	NIST

Similar Compounds

Find more compounds similar to Benzene, 1,1'-sulfonylbis[4-chloro-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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