Chemical Properties of 2,6-Dimethyl-3-methoxymethyl-p-benzoquinone

InChI

InChI=1S/C10H12O3/c1-6-4-9(11)8(5-13-3)7(2)10(6)12/h4H,5H2,1-3H3

InChI Key

REYIEWLSGQOMMT-UHFFFAOYSA-N

Formula

C10H12O3

SMILES

COCC1=C(C)C(=O)C(C)=CC1=O

Molecular Weight¹

180.20

Other Names

• 2,6-Dimethyl-3-(methoxymethyl)-benzoquinone

• 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.
• 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°	-253.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-501.54	kJ/mol	Joback Calculated Property
ΔfusH°	13.90	kJ/mol	Joback Calculated Property
ΔvapH°	52.07	kJ/mol	Joback Calculated Property
log10WS	-1.26		Crippen Calculated Property
logPoct/wat	1.047		Crippen Calculated Property
McVol	141.310	ml/mol	McGowan Calculated Property
Pc	2890.51	kPa	Joback Calculated Property
Inp	[1516.00; 1573.00]
Inp	1573.00		NIST
Inp	1516.00		NIST
Tboil	623.74	K	Joback Calculated Property
Tc	855.80	K	Joback Calculated Property
Tfus	411.83	K	Joback Calculated Property
Vc	0.533	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[352.99; 429.25]	J/mol×K	[623.74; 855.80]
Cp,gas	352.99	J/mol×K	623.74	Joback Calculated Property
Cp,gas	367.66	J/mol×K	662.42	Joback Calculated Property
Cp,gas	381.64	J/mol×K	701.09	Joback Calculated Property
Cp,gas	394.86	J/mol×K	739.77	Joback Calculated Property
Cp,gas	407.25	J/mol×K	778.45	Joback Calculated Property
Cp,gas	418.74	J/mol×K	817.13	Joback Calculated Property
Cp,gas	429.25	J/mol×K	855.80	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6-Dimethyl-3-methoxymethyl-p-benzoquinone.

Sources

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

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