Chemical Properties of Benzene, 1-ethenyl-4-(2-methylpropyl)- (CAS 63444-56-4)

InChI

InChI=1S/C12H16/c1-4-11-5-7-12(8-6-11)9-10(2)3/h4-8,10H,1,9H2,2-3H3

InChI Key

VTMSSJKVUVVWNJ-UHFFFAOYSA-N

Formula

C12H16

SMILES

C=Cc1ccc(CC(C)C)cc1

Molecular Weight¹

160.26

CAS

63444-56-4

Other Names

• 1-Isobutyl-4-vinylbenzene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[195.22; 488.88]	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			-3.22990e+01
Coefficient B			9.91340e-01
Coefficient C			-6.19260e-04
Coefficient D			1.49100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	195.22	J/mol×K	273.00	Calculated Property
Cp,gas	247.51	J/mol×K	353.78	Calculated Property
Cp,gas	293.79	J/mol×K	434.56	Calculated Property
Cp,gas	334.52	J/mol×K	515.33	Calculated Property
Cp,gas	370.18	J/mol×K	596.11	Calculated Property
Cp,gas	401.24	J/mol×K	676.89	Calculated Property
Cp,gas	428.16	J/mol×K	757.67	Calculated Property
Cp,gas	451.43	J/mol×K	838.44	Calculated Property
Cp,gas	471.52	J/mol×K	919.22	Calculated Property
Cp,gas	488.88	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0033600; 0.0001957]	Pa×s	[247.18; 498.04]	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			-1.13402e+01
Coefficient B			1.39518e+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.			247.18
Temperature range, max.			498.04
η	0.0033600	Pa×s	247.18	Calculated Property
η	0.0018964	Pa×s	275.05	Calculated Property
η	0.0011891	Pa×s	302.93	Calculated Property
η	0.0008067	Pa×s	330.80	Calculated Property
η	0.0005812	Pa×s	358.67	Calculated Property
η	0.0004391	Pa×s	386.55	Calculated Property
η	0.0003444	Pa×s	414.42	Calculated Property
η	0.0002786	Pa×s	442.29	Calculated Property
η	0.0002311	Pa×s	470.17	Calculated Property
η	0.0001957	Pa×s	498.04	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1-ethenyl-4-(2-methylpropyl)-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.