Chemical Properties of Benzene, 1-chloro-2-(chloromethyl)- (CAS 611-19-8)

InChI

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

InChI Key

BASMANVIUSSIIM-UHFFFAOYSA-N

Formula

C7H6Cl2

SMILES

ClCc1ccccc1Cl

Molecular Weight¹

161.03

CAS

611-19-8

Other Names

• 1-Chloro-2-(chloromethyl)benzene
• 2,alpha-Dichlorotoluene
• 2,«alpha»-Dichlorotoluene
• 2-Chlorobenzyl chloride
• NSC 8446
• Ortho-«alpha»-dichlorotoluene
• Toluene, o,«alpha»-dichloro-
• alpha,o-Dichlorotoluene
• o,«alpha»-dichlorotoluene
• o-Chlorobenzyl chloride
• «alpha»,2-Dichlorotoluene
• «alpha»,o-Dichlorotoluene

• ω : Acentric Factor.
• 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).
• 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).
• 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	[186.86; 236.29]	J/mol×K	[466.28; 694.39]
Cp,gas	186.86	J/mol×K	466.28	Joback Calculated Property
Cp,gas	196.62	J/mol×K	504.30	Joback Calculated Property
Cp,gas	205.73	J/mol×K	542.32	Joback Calculated Property
Cp,gas	214.23	J/mol×K	580.34	Joback Calculated Property
Cp,gas	222.13	J/mol×K	618.36	Joback Calculated Property
Cp,gas	229.47	J/mol×K	656.37	Joback Calculated Property
Cp,gas	236.29	J/mol×K	694.39	Joback Calculated Property
η	[0.0002872; 0.0022622]	Pa×s	[267.43; 466.28]
η	0.0022622	Pa×s	267.43	Joback Calculated Property
η	0.0013267	Pa×s	300.57	Joback Calculated Property
η	0.0008650	Pa×s	333.71	Joback Calculated Property
η	0.0006093	Pa×s	366.86	Joback Calculated Property
η	0.0004549	Pa×s	400.00	Joback Calculated Property
η	0.0003551	Pa×s	433.14	Joback Calculated Property
η	0.0002872	Pa×s	466.28	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.65]	kPa	[359.62; 518.49]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.42356e+01
Coefficient B			-3.93626e+03
Coefficient C			-7.74120e+01
Temperature range, min.			359.62
Temperature range, max.			518.49
Pvap	1.33	kPa	359.62	Calculated Property
Pvap	3.03	kPa	377.27	Calculated Property
Pvap	6.29	kPa	394.92	Calculated Property
Pvap	12.08	kPa	412.58	Calculated Property
Pvap	21.74	kPa	430.23	Calculated Property
Pvap	36.99	kPa	447.88	Calculated Property
Pvap	59.97	kPa	465.53	Calculated Property
Pvap	93.23	kPa	483.19	Calculated Property
Pvap	139.69	kPa	500.84	Calculated Property
Pvap	202.65	kPa	518.49	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-chloro-2-(chloromethyl)-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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