Chemical Properties of Hexanoic acid, 6-hydroxy- (CAS 1191-25-9)

InChI

InChI=1S/C6H12O3/c7-5-3-1-2-4-6(8)9/h7H,1-5H2,(H,8,9)

InChI Key

IWHLYPDWHHPVAA-UHFFFAOYSA-N

Formula

C6H12O3

SMILES

O=C(O)CCCCCO

Molecular Weight¹

132.16

CAS

1191-25-9

Other Names

• 6-Hydroxycaproic acid
• 6-Hydroxyhexanoic acid

• 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_fH°_solid : Solid phase 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).
• 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

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Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[158.89; 358.32]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			7.32500e+00
Coefficient B			6.58600e-01
Coefficient C			-4.05600e-04
Coefficient D			9.80000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	158.89	J/mol×K	273.00	Calculated Property
Cp,gas	193.90	J/mol×K	353.78	Calculated Property
Cp,gas	224.97	J/mol×K	434.56	Calculated Property
Cp,gas	252.42	J/mol×K	515.33	Calculated Property
Cp,gas	276.55	J/mol×K	596.11	Calculated Property
Cp,gas	297.68	J/mol×K	676.89	Calculated Property
Cp,gas	316.11	J/mol×K	757.67	Calculated Property
Cp,gas	332.16	J/mol×K	838.44	Calculated Property
Cp,gas	346.12	J/mol×K	919.22	Calculated Property
Cp,gas	358.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0023170; 0.0001883]	Pa×s	[378.80; 528.05]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.49480e+01
Coefficient B			3.36393e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			378.80
Temperature range, max.			528.05
η	0.0023170	Pa×s	378.80	Calculated Property
η	0.0015965	Pa×s	395.38	Calculated Property
η	0.0011335	Pa×s	411.97	Calculated Property
η	0.0008264	Pa×s	428.55	Calculated Property
η	0.0006169	Pa×s	445.13	Calculated Property
η	0.0004702	Pa×s	461.71	Calculated Property
η	0.0003653	Pa×s	478.30	Calculated Property
η	0.0002886	Pa×s	494.88	Calculated Property
η	0.0002315	Pa×s	511.46	Calculated Property
η	0.0001883	Pa×s	528.05	Calculated Property

Similar Compounds

Find more compounds similar to Hexanoic acid, 6-hydroxy-.

Sources

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

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