Chemical Properties of 2,3-Epoxyhexanol (CAS 90528-63-5)

InChI

InChI=1S/C6H12O2/c1-2-3-5-6(4-7)8-5/h5-7H,2-4H2,1H3

InChI Key

IGRZECZSICIWJA-UHFFFAOYSA-N

Formula

C6H12O2

SMILES

CCCC1OC1CO

Molecular Weight¹

116.16

CAS

90528-63-5

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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 : 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°	-170.26	kJ/mol	Joback Calculated Property
ΔfH°gas	-398.94	kJ/mol	Joback Calculated Property
ΔfusH°	22.57	kJ/mol	Joback Calculated Property
ΔvapH°	49.74	kJ/mol	Joback Calculated Property
log10WS	-0.80		Crippen Calculated Property
logPoct/wat	0.546		Crippen Calculated Property
McVol	96.280	ml/mol	McGowan Calculated Property
Pc	3838.78	kPa	Joback Calculated Property
I	[1421.00; 1428.00]
I	1428.00		NIST
I	1421.00		NIST
I	1428.00		NIST
Tboil	457.88	K	Joback Calculated Property
Tc	631.77	K	Joback Calculated Property
Tfus	258.47	K	Joback Calculated Property
Vc	0.367	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[220.90; 276.69]	J/mol×K	[457.88; 631.77]
Cp,gas	220.90	J/mol×K	457.88	Joback Calculated Property
Cp,gas	231.35	J/mol×K	486.86	Joback Calculated Property
Cp,gas	241.32	J/mol×K	515.84	Joback Calculated Property
Cp,gas	250.81	J/mol×K	544.83	Joback Calculated Property
Cp,gas	259.86	J/mol×K	573.81	Joback Calculated Property
Cp,gas	268.48	J/mol×K	602.79	Joback Calculated Property
Cp,gas	276.69	J/mol×K	631.77	Joback Calculated Property
η	[0.0004198; 0.0134670]	Pa×s	[258.47; 457.88]
η	0.0134670	Pa×s	258.47	Joback Calculated Property
η	0.0054354	Pa×s	291.71	Joback Calculated Property
η	0.0026412	Pa×s	324.94	Joback Calculated Property
η	0.0014673	Pa×s	358.18	Joback Calculated Property
η	0.0009008	Pa×s	391.41	Joback Calculated Property
η	0.0005968	Pa×s	424.64	Joback Calculated Property
η	0.0004198	Pa×s	457.88	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,3-Epoxyhexanol.

Sources

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

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