Chemical Properties of Thiophene, tetrachloro- (CAS 6012-97-1)

InChI

InChI=1S/C4Cl4S/c5-1-2(6)4(8)9-3(1)7

InChI Key

WZXXZHONLFRKGG-UHFFFAOYSA-N

Formula

C4Cl4S

SMILES

Clc1sc(Cl)c(Cl)c1Cl

Molecular Weight¹

221.92

CAS

6012-97-1

Other Names

• 2,3,4,5-Chlorothiophene
• 2,3,4,5-Tetrachlorothiophene
• ENT 25,764
• IF
• IF (Fumigant)
• NSC 44615
• NSC 61442
• Pemphene
• Penn salt td-183
• Penphene
• Perchlorothiophene
• TCTP
• TD-183
• Tetrachlorothiofene
• Tetrachlorothiophene
• Tetrachlorthiofen
• Thiophene, 2,3,4,5-tetrachloro-

• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_vap : Vapor pressure (kPa).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[374.98; 539.12]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.44935e+01
Coefficient B			-4.26179e+03
Coefficient C			-7.49760e+01
Temperature range, min.			374.98
Temperature range, max.			539.12
Pvap	1.33	kPa	374.98	Calculated Property
Pvap	3.01	kPa	393.22	Calculated Property
Pvap	6.22	kPa	411.46	Calculated Property
Pvap	11.93	kPa	429.69	Calculated Property
Pvap	21.47	kPa	447.93	Calculated Property
Pvap	36.57	kPa	466.17	Calculated Property
Pvap	59.41	kPa	484.41	Calculated Property
Pvap	92.61	kPa	502.64	Calculated Property
Pvap	139.21	kPa	520.88	Calculated Property
Pvap	202.65	kPa	539.12	Calculated Property

Similar Compounds

Find more compounds similar to Thiophene, tetrachloro-.

Sources

• 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
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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