Chemical Properties of 2,4-Dihydroxy-2,5-dimethyl-3(2H)-furan-3-one (CAS 10230-62-3)

InChI

InChI=1S/C6H8O4/c1-3-4(7)5(8)6(2,9)10-3/h7,9H,1-2H3

InChI Key

GMQUMWVEWMCMOQ-UHFFFAOYSA-N

Formula

C6H8O4

SMILES

CC1=C(O)C(=O)C(C)(O)O1

Molecular Weight¹

144.13

CAS

10230-62-3

Other Names

• 2,4-Dihydroxy-2,5-dimethyl-3(2H)-furanone
• 2,5-Dimethyl-2,4-dihydroxy-3(2H)-furanone

• 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°	-440.95	kJ/mol	Joback Calculated Property
ΔfH°gas	-630.77	kJ/mol	Joback Calculated Property
ΔfusH°	15.04	kJ/mol	Joback Calculated Property
ΔvapH°	71.79	kJ/mol	Joback Calculated Property
log10WS	-0.63		Crippen Calculated Property
logPoct/wat	0.084		Crippen Calculated Property
McVol	99.420	ml/mol	McGowan Calculated Property
Pc	5462.66	kPa	Joback Calculated Property
Inp	[977.00; 1026.80]
Inp	1026.80		NIST
Inp	977.00		NIST
Inp	989.00		NIST
Inp	1026.80		NIST
Tboil	640.45	K	Joback Calculated Property
Tc	841.00	K	Joback Calculated Property
Tfus	434.41	K	Joback Calculated Property
Vc	0.362	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[260.14; 303.58]	J/mol×K	[640.45; 841.00]
Cp,gas	260.14	J/mol×K	640.45	Joback Calculated Property
Cp,gas	267.83	J/mol×K	673.87	Joback Calculated Property
Cp,gas	275.26	J/mol×K	707.30	Joback Calculated Property
Cp,gas	282.49	J/mol×K	740.72	Joback Calculated Property
Cp,gas	289.59	J/mol×K	774.15	Joback Calculated Property
Cp,gas	296.60	J/mol×K	807.57	Joback Calculated Property
Cp,gas	303.58	J/mol×K	841.00	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,4-Dihydroxy-2,5-dimethyl-3(2H)-furan-3-one.

Sources

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

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