Chemical Properties of 1,4-Ethenonaphthalene, 1,4-dihydro- (CAS 7322-47-6)

InChI

InChI=1S/C12H10/c1-2-4-12-10-7-5-9(6-8-10)11(12)3-1/h1-10H

InChI Key

HQFAAEWHTFVMMR-UHFFFAOYSA-N

Formula

C12H10

SMILES

C1=CC2C=CC1c1ccccc12

Molecular Weight¹

154.21

CAS

7322-47-6

Other Names

• Benzobarrelene
• Benzobicyclo[2.2.2]octatriene

• 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

Property	Value	Unit	Source
ΔfG°	334.36	kJ/mol	Joback Calculated Property
ΔfH°gas	195.21	kJ/mol	Joback Calculated Property
ΔfusH°	19.20	kJ/mol	Joback Calculated Property
ΔvapH°	45.65	kJ/mol	Joback Calculated Property
IE	[8.00; 8.12]	eV
IE	8.00	eV	NIST
IE	8.12	eV	NIST
log10WS	-3.34		Crippen Calculated Property
logPoct/wat	2.993		Crippen Calculated Property
McVol	125.860	ml/mol	McGowan Calculated Property
Pc	3372.36	kPa	Joback Calculated Property
Tboil	517.42	K	Joback Calculated Property
Tc	756.04	K	Joback Calculated Property
Tfus	301.34	K	Joback Calculated Property
Vc	0.485	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[282.96; 361.42]	J/mol×K	[517.42; 756.04]
Cp,gas	282.96	J/mol×K	517.42	Joback Calculated Property
Cp,gas	299.10	J/mol×K	557.19	Joback Calculated Property
Cp,gas	313.84	J/mol×K	596.96	Joback Calculated Property
Cp,gas	327.32	J/mol×K	636.73	Joback Calculated Property
Cp,gas	339.65	J/mol×K	676.50	Joback Calculated Property
Cp,gas	350.98	J/mol×K	716.27	Joback Calculated Property
Cp,gas	361.42	J/mol×K	756.04	Joback Calculated Property
η	[0.0008515; 0.0011225]	Pa×s	[301.34; 517.42]
η	0.0011225	Pa×s	301.34	Joback Calculated Property
η	0.0010459	Pa×s	337.35	Joback Calculated Property
η	0.0009880	Pa×s	373.37	Joback Calculated Property
η	0.0009427	Pa×s	409.38	Joback Calculated Property
η	0.0009063	Pa×s	445.39	Joback Calculated Property
η	0.0008764	Pa×s	481.41	Joback Calculated Property
η	0.0008515	Pa×s	517.42	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,4-Ethenonaphthalene, 1,4-dihydro-.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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