Chemical Properties of Benzene, 1,4-diethenyl- (CAS 105-06-6)

InChI

InChI=1S/C10H10/c1-3-9-5-7-10(4-2)8-6-9/h3-8H,1-2H2

InChI Key

WEERVPDNCOGWJF-UHFFFAOYSA-N

Formula

C10H10

SMILES

C=Cc1ccc(C=C)cc1

Molecular Weight¹

130.19

CAS

105-06-6

Other Names

• 1,4-Divinylbenzene
• 1,4-Diethenyl benzene

• 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.
• I : 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	0.3619		Relay (1.0) Calculated Property
ΔfH°gas	211.60	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	12.75	kJ/mol	Joback Calculated Property
ΔvapH°	52.70	kJ/mol	Relay (1.0) Calculated Property
IE	8.11	eV	NIST
log10WS	-3.54		Relay (1.0) Calculated Property
logPoct/wat	2.973		Crippen Calculated Property
McVol	119.400	ml/mol	McGowan Calculated Property
Pc	3163.27	kPa	Joback Calculated Property
Inp	[184.20; 1100.00]
Inp	1100.00		NIST
Inp	1093.20		NIST
Inp	1100.00		NIST
Inp	1096.00		NIST
Inp	184.20		NIST
Inp	184.20		NIST
Inp	1100.00		NIST
I	[1554.00; 1554.20]
I	1554.20		NIST
I	1554.00		NIST
I	1554.20		NIST
Tboil	480.30	K	Relay (1.0) Calculated Property
Tc	689.14	K	Relay (1.0) Calculated Property
Tfus	[303.15; 304.15]	K
Tfus	303.15 ± 2.00	K	NIST
Tfus	304.15 ± 2.00	K	NIST
Vc	0.436	m3/kmol	Relay (1.0) Calculated Property

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	[143.30; 356.65]	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			-3.17900e+01
Coefficient B			7.75400e-01
Coefficient C			-5.30160e-04
Coefficient D			1.43200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	143.30	J/mol×K	273.00	Calculated Property
Cp,gas	182.52	J/mol×K	353.78	Calculated Property
Cp,gas	216.80	J/mol×K	434.56	Calculated Property
Cp,gas	246.60	J/mol×K	515.33	Calculated Property
Cp,gas	272.38	J/mol×K	596.11	Calculated Property
Cp,gas	294.57	J/mol×K	676.89	Calculated Property
Cp,gas	313.65	J/mol×K	757.67	Calculated Property
Cp,gas	330.05	J/mol×K	838.44	Calculated Property
Cp,gas	344.23	J/mol×K	919.22	Calculated Property
Cp,gas	356.65	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007147; 0.0001992]	Pa×s	[303.65; 468.20]	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			-1.08790e+01
Coefficient B			1.10388e+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.			303.65
Temperature range, max.			468.20
η	0.0007147	Pa×s	303.65	Calculated Property
η	0.0005814	Pa×s	321.93	Calculated Property
η	0.0004835	Pa×s	340.22	Calculated Property
η	0.0004098	Pa×s	358.50	Calculated Property
η	0.0003529	Pa×s	376.78	Calculated Property
η	0.0003082	Pa×s	395.07	Calculated Property
η	0.0002723	Pa×s	413.35	Calculated Property
η	0.0002432	Pa×s	431.63	Calculated Property
η	0.0002192	Pa×s	449.92	Calculated Property
η	0.0001992	Pa×s	468.20	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1,4-diethenyl-.

Sources

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

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