Chemical Properties of Benzene, 1-iodo-4-(1-methylethyl)-

InChI

InChI=1S/C9H11I/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,1-2H3

InChI Key

PQJOSEVTIKYWLH-UHFFFAOYSA-N

Formula

C9H11I

SMILES

CC(C)c1ccc(I)cc1

Molecular Weight¹

246.09

Other Names

• p-iodocumene

• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[158.46; 371.79]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.48900e+01
Coefficient B			7.65340e-01
Coefficient C			-5.14560e-04
Coefficient D			1.35900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.46	J/mol×K	273.00	Calculated Property
Cp,gas	197.49	J/mol×K	353.78	Calculated Property
Cp,gas	231.68	J/mol×K	434.56	Calculated Property
Cp,gas	261.46	J/mol×K	515.33	Calculated Property
Cp,gas	287.28	J/mol×K	596.11	Calculated Property
Cp,gas	309.55	J/mol×K	676.89	Calculated Property
Cp,gas	328.70	J/mol×K	757.67	Calculated Property
Cp,gas	345.18	J/mol×K	838.44	Calculated Property
Cp,gas	359.40	J/mol×K	919.22	Calculated Property
Cp,gas	371.79	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0039156; 0.0002379]	Pa×s	[273.19; 545.36]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.11553e+01
Coefficient B			1.53328e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			273.19
Temperature range, max.			545.36
η	0.0039156	Pa×s	273.19	Calculated Property
η	0.0022380	Pa×s	303.43	Calculated Property
η	0.0014157	Pa×s	333.67	Calculated Property
η	0.0009663	Pa×s	363.91	Calculated Property
η	0.0006994	Pa×s	394.16	Calculated Property
η	0.0005301	Pa×s	424.40	Calculated Property
η	0.0004169	Pa×s	454.64	Calculated Property
η	0.0003378	Pa×s	484.88	Calculated Property
η	0.0002806	Pa×s	515.12	Calculated Property
η	0.0002379	Pa×s	545.36	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-iodo-4-(1-methylethyl)-.

Sources

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

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