Chemical Properties of 1,1-di-o-Tolylethylene (CAS 2919-19-9)

InChI

InChI=1S/C16H16/c1-12-8-4-6-10-15(12)14(3)16-11-7-5-9-13(16)2/h4-11H,3H2,1-2H3

InChI Key

MUZMRKGPXHDTOF-UHFFFAOYSA-N

Formula

C16H16

SMILES

C=C(c1ccccc1C)c1ccccc1C

Molecular Weight¹

208.30

CAS

2919-19-9

• ω : Acentric Factor.
• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_boilr : Boiling point at reduced pressure (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	0.5028		Relay (1.0) Calculated Property
ΔcH°solid	[-8671.80; -8531.00]	kJ/mol
ΔcH°solid	-8671.80 ± 2.00	kJ/mol	NIST
ΔcH°solid	-8531.00 ± 2.00	kJ/mol	NIST
ΔfG°	368.69	kJ/mol	Joback Calculated Property
ΔfH°gas	227.74	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.91	kJ/mol	Joback Calculated Property
ΔvapH°	79.30	kJ/mol	Relay (1.0) Calculated Property
IE	7.80	eV	Relay (1.0) Calculated Property
log10WS	-5.09		Relay (1.0) Calculated Property
logPoct/wat	4.365		Crippen Calculated Property
McVol	184.480	ml/mol	McGowan Calculated Property
Pc	2322.54	kPa	Joback Calculated Property
Tboil	580.47	K	Relay (1.0) Calculated Property
Tc	819.99	K	Relay (1.0) Calculated Property
Tfus	308.85	K	Relay (1.0) Calculated Property
Vc	0.673	m3/kmol	Relay (1.0) Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[225.83; 572.87]	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			-5.35500e+01
Coefficient B			1.22694e+00
Coefficient C			-8.00120e-04
Coefficient D			1.99600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	225.83	J/mol×K	273.00	Calculated Property
Cp,gas	289.21	J/mol×K	353.78	Calculated Property
Cp,gas	344.91	J/mol×K	434.56	Calculated Property
Cp,gas	393.56	J/mol×K	515.33	Calculated Property
Cp,gas	435.80	J/mol×K	596.11	Calculated Property
Cp,gas	472.26	J/mol×K	676.89	Calculated Property
Cp,gas	503.56	J/mol×K	757.67	Calculated Property
Cp,gas	530.34	J/mol×K	838.44	Calculated Property
Cp,gas	553.24	J/mol×K	919.22	Calculated Property
Cp,gas	572.87	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to 1,1-di-o-Tolylethylene.

Sources

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

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