Chemical Properties of Benzene, 1-chloro-2,3-dimethyl- (CAS 608-23-1)

InChI

InChI=1S/C8H9Cl/c1-6-4-3-5-8(9)7(6)2/h3-5H,1-2H3

InChI Key

NVLHGZIXTRYOKT-UHFFFAOYSA-N

Formula

C8H9Cl

SMILES

Cc1cccc(Cl)c1C

Molecular Weight¹

140.61

CAS

608-23-1

• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.3243		Relay (1.0) Calculated Property
ΔfG°	97.70	kJ/mol	Joback Calculated Property
ΔfH°gas	-15.10	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.94	kJ/mol	Joback Calculated Property
ΔvapH°	49.62	kJ/mol	Relay (1.0) Calculated Property
IE	8.62	eV	Relay (1.0) Calculated Property
log10WS	-3.61		Relay (1.0) Calculated Property
logPoct/wat	2.957		Crippen Calculated Property
McVol	112.060	ml/mol	McGowan Calculated Property
Pc	3372.36	kPa	Joback Calculated Property
Inp	[1046.00; 1119.00]
Inp	1119.00		NIST
Inp	1082.00		NIST
Inp	1046.00		NIST
Tboil	463.32	K	Relay (1.0) Calculated Property
Tc	689.41	K	Relay (1.0) Calculated Property
Tfus	299.49	K	Relay (1.0) Calculated Property
Vc	0.409	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[202.65; 261.31]	J/mol×K	[456.51; 676.11]
Cp,gas	202.65	J/mol×K	456.51	Joback Calculated Property
Cp,gas	213.88	J/mol×K	493.11	Joback Calculated Property
Cp,gas	224.50	J/mol×K	529.71	Joback Calculated Property
Cp,gas	234.54	J/mol×K	566.31	Joback Calculated Property
Cp,gas	244.00	J/mol×K	602.91	Joback Calculated Property
Cp,gas	252.92	J/mol×K	639.51	Joback Calculated Property
Cp,gas	261.31	J/mol×K	676.11	Joback Calculated Property
η	[0.0002426; 0.0016353]	Pa×s	[261.30; 456.51]
η	0.0016353	Pa×s	261.30	Joback Calculated Property
η	0.0009978	Pa×s	293.84	Joback Calculated Property
η	0.0006718	Pa×s	326.37	Joback Calculated Property
η	0.0004860	Pa×s	358.90	Joback Calculated Property
η	0.0003710	Pa×s	391.44	Joback Calculated Property
η	0.0002952	Pa×s	423.98	Joback Calculated Property
η	0.0002426	Pa×s	456.51	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-chloro-2,3-dimethyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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