Chemical Properties of Dibenzofuran, 4-methyl- (CAS 7320-53-8)

InChI

InChI=1S/C13H10O/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8H,1H3

InChI Key

XLTFRTTTZWMJJQ-UHFFFAOYSA-N

Formula

C13H10O

SMILES

Cc1cccc2c1oc1ccccc12

Molecular Weight¹

182.22

CAS

7320-53-8

Other Names

• 4-Methyldibenzofuran

• ω : Acentric Factor.
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation 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

Property	Value	Unit	Source
ω	0.4787		Relay (1.0) Calculated Property
ΔfG°	166.94	kJ/mol	Relay (1.0-beta) Calculated Property
ΔfH°gas	46.11	kJ/mol	Relay (1.0) Calculated Property
ΔvapH°	79.76	kJ/mol	Relay (1.0) Calculated Property
IE	7.84	eV	Relay (1.0) Calculated Property
log10WS	-5.03		Relay (1.0) Calculated Property
logPoct/wat	3.894		Crippen Calculated Property
McVol	141.520	ml/mol	McGowan Calculated Property
Pc	3095.79	kPa	Relay (1.0-beta) Calculated Property
Inp	[271.30; 1639.00]
Inp	1639.00		NIST
Inp	1638.00		NIST
Inp	279.10		NIST
Inp	271.38		NIST
Inp	271.30		NIST
Inp	1639.00		NIST
Tboil	575.06	K	Relay (1.0) Calculated Property
Tc	856.25	K	Relay (1.0) Calculated Property
Tfus	343.66	K	Relay (1.0) Calculated Property
Vc	0.551	m3/kmol	Relay (1.0) Calculated Property

Similar Compounds

Find more compounds similar to Dibenzofuran, 4-methyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen 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.