Chemical Properties of Phenanthrene, 3-fluoro

InChI

InChI=1S/C14H9F/c15-12-8-7-11-6-5-10-3-1-2-4-13(10)14(11)9-12/h1-9H

InChI Key

DUSQHUWREPHMLT-UHFFFAOYSA-N

Formula

C14H9F

SMILES

Fc1ccc2ccc3ccccc3c2c1

Molecular Weight¹

196.22

• 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).
• 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
ΔfG°	178.64	kJ/mol	Joback Calculated Property
ΔfH°gas	67.33	kJ/mol	Joback Calculated Property
ΔfusH°	22.40	kJ/mol	Joback Calculated Property
ΔvapH°	52.82	kJ/mol	Joback Calculated Property
log10WS	-5.41		Crippen Calculated Property
logPoct/wat	4.132		Crippen Calculated Property
McVol	147.210	ml/mol	McGowan Calculated Property
Pc	3032.27	kPa	Joback Calculated Property
Inp	[297.01; 1727.00]
Inp	1726.00		NIST
Inp	1727.00		NIST
Inp	297.01		NIST
Inp	297.18		NIST
I	[296.87; 296.87]
I	296.87		NIST
I	296.87		NIST
Tboil	593.59	K	Joback Calculated Property
Tc	835.50	K	Joback Calculated Property
Tfus	364.99	K	Joback Calculated Property
Vc	0.574	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[341.61; 409.57]	J/mol×K	[593.59; 835.50]
Cp,gas	341.61	J/mol×K	593.59	Joback Calculated Property
Cp,gas	355.44	J/mol×K	633.91	Joback Calculated Property
Cp,gas	368.11	J/mol×K	674.23	Joback Calculated Property
Cp,gas	379.74	J/mol×K	714.54	Joback Calculated Property
Cp,gas	390.45	J/mol×K	754.86	Joback Calculated Property
Cp,gas	400.35	J/mol×K	795.18	Joback Calculated Property
Cp,gas	409.57	J/mol×K	835.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to Phenanthrene, 3-fluoro.

Sources

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

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