Chemical Properties of Decanoic acid, 2-hydroxy- (CAS 5393-81-7)

InChI

InChI=1S/C10H20O3/c1-2-3-4-5-6-7-8-9(11)10(12)13/h9,11H,2-8H2,1H3,(H,12,13)

InChI Key

GHPVDCPCKSNJDR-UHFFFAOYSA-N

Formula

C10H20O3

SMILES

CCCCCCCCC(O)C(=O)O

Molecular Weight¹

188.26

CAS

5393-81-7

Other Names

• «alpha»-Hydroxydecanoic acid
• 2-Hydroxydecanoic acid

• ω : Acentric Factor.
• 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).
• 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	0.9199		Relay (1.0) Calculated Property
ΔfG°	-449.85	kJ/mol	Joback Calculated Property
ΔfH°gas	-761.91	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.36	kJ/mol	Joback Calculated Property
ΔvapH°	96.89	kJ/mol	Relay (1.0) Calculated Property
IE	10.25	eV	Relay (1.0) Calculated Property
log10WS	-1.90		Relay (1.0) Calculated Property
logPoct/wat	2.183		Crippen Calculated Property
McVol	165.070	ml/mol	McGowan Calculated Property
Pc	2527.73	kPa	Joback Calculated Property
Inp	[1557.00; 1557.00]
Inp	1557.00		NIST
Inp	1557.00		NIST
Tboil	538.20	K	Relay (1.0) Calculated Property
Tc	752.49	K	Relay (1.0) Calculated Property
Tfus	320.37	K	Relay (1.0) Calculated Property
Vc	0.631	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[243.43; 565.23]	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			2.00700e+00
Coefficient B			1.04452e+00
Coefficient C			-6.26400e-04
Coefficient D			1.45100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	243.43	J/mol×K	273.00	Calculated Property
Cp,gas	299.56	J/mol×K	353.78	Calculated Property
Cp,gas	349.53	J/mol×K	434.56	Calculated Property
Cp,gas	393.79	J/mol×K	515.33	Calculated Property
Cp,gas	432.80	J/mol×K	596.11	Calculated Property
Cp,gas	467.03	J/mol×K	676.89	Calculated Property
Cp,gas	496.93	J/mol×K	757.67	Calculated Property
Cp,gas	522.95	J/mol×K	838.44	Calculated Property
Cp,gas	545.57	J/mol×K	919.22	Calculated Property
Cp,gas	565.23	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0018672; 0.0001089]	Pa×s	[408.88; 590.50]	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			-1.55241e+01
Coefficient B			3.77839e+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.			408.88
Temperature range, max.			590.50
η	0.0018672	Pa×s	408.88	Calculated Property
η	0.0012090	Pa×s	429.06	Calculated Property
η	0.0008140	Pa×s	449.24	Calculated Property
η	0.0005670	Pa×s	469.42	Calculated Property
η	0.0004069	Pa×s	489.60	Calculated Property
η	0.0002998	Pa×s	509.78	Calculated Property
η	0.0002261	Pa×s	529.96	Calculated Property
η	0.0001741	Pa×s	550.14	Calculated Property
η	0.0001365	Pa×s	570.32	Calculated Property
η	0.0001089	Pa×s	590.50	Calculated Property

Similar Compounds

Find more compounds similar to Decanoic acid, 2-hydroxy-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.