Chemical Properties of Benzene, 1-chloro-4-(chloromethyl)- (CAS 104-83-6)

InChI

InChI=1S/C7H6Cl2/c8-5-6-1-3-7(9)4-2-6/h1-4H,5H2

InChI Key

JQZAEUFPPSRDOP-UHFFFAOYSA-N

Formula

C7H6Cl2

SMILES

ClCc1ccc(Cl)cc1

Molecular Weight¹

161.03

CAS

104-83-6

Other Names

• (4-Chlorophenyl)methyl chloride
• 1-Chloro-4-(chloromethyl)benzene
• 4-Chlorobenzyl chloride
• NSC 34032
• Toluene, p,«alpha»-dichloro-
• Toluene, p,«alpha»-dichloro-
• p,«alpha»-Dichlorotoluene
• p,«alpha»-Dichlorotoluene
• p-Chlorobenzyl chloride
• p-Chlorophenylmethyl chloride
• «alpha»,4-Dichlorotoluene
• «alpha»,p-Dichlorotoluene
• «alpha»,4-Dichlorotoluene
• «alpha»,p-Dichlorotoluene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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_vapH° : Enthalpy of vaporization at standard conditions (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).
• P_vap : Vapor pressure (kPa).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[186.80; 236.24]	J/mol×K	[466.08; 694.10]
Cp,gas	186.80	J/mol×K	466.08	Joback Calculated Property
Cp,gas	196.57	J/mol×K	504.08	Joback Calculated Property
Cp,gas	205.68	J/mol×K	542.09	Joback Calculated Property
Cp,gas	214.17	J/mol×K	580.09	Joback Calculated Property
Cp,gas	222.08	J/mol×K	618.09	Joback Calculated Property
Cp,gas	229.42	J/mol×K	656.09	Joback Calculated Property
Cp,gas	236.24	J/mol×K	694.10	Joback Calculated Property
η	[0.0002875; 0.0022622]	Pa×s	[267.43; 466.08]
η	0.0022622	Pa×s	267.43	Joback Calculated Property
η	0.0013273	Pa×s	300.54	Joback Calculated Property
η	0.0008657	Pa×s	333.65	Joback Calculated Property
η	0.0006099	Pa×s	366.75	Joback Calculated Property
η	0.0004554	Pa×s	399.86	Joback Calculated Property
η	0.0003555	Pa×s	432.97	Joback Calculated Property
η	0.0002875	Pa×s	466.08	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[364.42; 505.87]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.54460e+01
Coefficient B			-4.32529e+03
Coefficient C			-7.90800e+01
Temperature range, min.			364.42
Temperature range, max.			505.87
Pvap	1.33	kPa	364.42	Calculated Property
Pvap	2.94	kPa	380.14	Calculated Property
Pvap	6.00	kPa	395.85	Calculated Property
Pvap	11.44	kPa	411.57	Calculated Property
Pvap	20.58	kPa	427.29	Calculated Property
Pvap	35.19	kPa	443.00	Calculated Property
Pvap	57.56	kPa	458.72	Calculated Property
Pvap	90.53	kPa	474.44	Calculated Property
Pvap	137.55	kPa	490.15	Calculated Property
Pvap	202.65	kPa	505.87	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-chloro-4-(chloromethyl)-.

Sources

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

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