Chemical Properties of 1(2H)-Naphthalenone, 5-methoxy

InChI

InChI=1S/C11H10O2/c1-13-11-7-3-4-8-9(11)5-2-6-10(8)12/h2-5,7H,6H2,1H3

InChI Key

OCGGHDQBFJYJQT-UHFFFAOYSA-N

Formula

C11H10O2

SMILES

COc1cccc2c1C=CCC2=O

Molecular Weight¹

174.20

• ω : Acentric Factor.
• 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).
• 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	0.4925		Relay (... Calculated Property
ΔfG°	-6.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-148.17	kJ/mol	Relay (... Calculated Property
ΔfusH°	14.39	kJ/mol	Joback Calculated Property
ΔvapH°	75.83	kJ/mol	Relay (... Calculated Property
IE	7.99	eV	Relay (... Calculated Property
log10WS	-2.85		Relay (... Calculated Property
logPoct/wat	2.295		Crippen Calculated Property
McVol	134.370	ml/mol	McGowan Calculated Property
Pc	3337.38	kPa	Joback Calculated Property
Inp	[1690.00; 1690.00]
Inp	1690.00		NIST
Inp	1690.00		NIST
Tboil	576.16	K	Relay (... Calculated Property
Tc	803.89	K	Relay (... Calculated Property
Tfus	361.04	K	Relay (... Calculated Property
Vc	0.477	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[318.49; 391.80]	J/mol×K	[592.80; 836.85]
Cp,gas	318.49	J/mol×K	592.80	Joback Calculated Property
Cp,gas	332.96	J/mol×K	633.48	Joback Calculated Property
Cp,gas	346.52	J/mol×K	674.15	Joback Calculated Property
Cp,gas	359.17	J/mol×K	714.83	Joback Calculated Property
Cp,gas	370.92	J/mol×K	755.50	Joback Calculated Property
Cp,gas	381.79	J/mol×K	796.18	Joback Calculated Property
Cp,gas	391.80	J/mol×K	836.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1(2H)-Naphthalenone, 5-methoxy.

Sources

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

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