Chemical Properties of 5-Decanol (CAS 5205-34-5)

InChI

InChI=1S/C10H22O/c1-3-5-7-9-10(11)8-6-4-2/h10-11H,3-9H2,1-2H3

InChI Key

SZMNDOUFZGODBR-UHFFFAOYSA-N

Formula

C10H22O

SMILES

CCCCCC(O)CCCC

Molecular Weight¹

158.28

CAS

5205-34-5

Other Names

• decan-5-ol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase 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).
• P_vap : Vapor pressure (kPa).
• ρ_c : Critical density (kg/m³).
• I_np : Non-polar retention indices.
• 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
ω	0.7000		Relay (1.0) Calculated Property
ΔfG°	-105.94	kJ/mol	Joback Calculated Property
ΔfH°gas	-424.63	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.22	kJ/mol	Joback Calculated Property
ΔvapH°	76.68	kJ/mol	Relay (1.0) Calculated Property
IE	9.75	eV	Relay (1.0) Calculated Property
log10WS	-3.06		Relay (1.0) Calculated Property
logPoct/wat	3.118		Crippen Calculated Property
McVol	157.630	ml/mol	McGowan Calculated Property
Pc	2315.84	kPa	Joback Calculated Property
ρc	[245.34; 245.34]	kg/m3
ρc	245.34	kg/m3	NIST
ρc	245.34 ± 6.33	kg/m3	NIST
Inp	[1175.00; 1181.00]
Inp	1181.00		NIST
Inp	1175.00		NIST
Inp	1175.00		NIST
Inp	1175.00		NIST
I	[1550.00; 1574.00]
I	1574.00		NIST
I	1550.00		NIST
I	1550.00		NIST
Tboil	478.22	K	Relay (1.0) Calculated Property
Tc	[663.00; 663.23]	K
Tc	663.00 ± 1.00	K	NIST
Tc	663.20	K	NIST
Tc	663.23 ± 0.30	K	NIST
Tfus	268.04	K	Relay (1.0) Calculated Property
Vc	0.646	m3/kmol	NIST

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[229.81; 554.45]	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			-2.59300e+00
Coefficient B			9.93740e-01
Coefficient C			-5.53800e-04
Coefficient D			1.17100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	229.81	J/mol×K	273.00	Calculated Property
Cp,gas	284.84	J/mol×K	353.78	Calculated Property
Cp,gas	334.27	J/mol×K	434.56	Calculated Property
Cp,gas	378.47	J/mol×K	515.33	Calculated Property
Cp,gas	417.80	J/mol×K	596.11	Calculated Property
Cp,gas	452.64	J/mol×K	676.89	Calculated Property
Cp,gas	483.35	J/mol×K	757.67	Calculated Property
Cp,gas	510.31	J/mol×K	838.44	Calculated Property
Cp,gas	533.88	J/mol×K	919.22	Calculated Property
Cp,gas	554.45	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0660457; 0.0002351]	Pa×s	[248.28; 464.20]	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			-1.48386e+01
Coefficient B			3.00945e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			248.28
Temperature range, max.			464.20
η	0.0660457	Pa×s	248.28	Calculated Property
η	0.0226983	Pa×s	272.27	Calculated Property
η	0.0092740	Pa×s	296.26	Calculated Property
η	0.0043329	Pa×s	320.25	Calculated Property
η	0.0022509	Pa×s	344.24	Calculated Property
η	0.0012735	Pa×s	368.24	Calculated Property
η	0.0007725	Pa×s	392.23	Calculated Property
η	0.0004964	Pa×s	416.22	Calculated Property
η	0.0003347	Pa×s	440.21	Calculated Property
η	0.0002351	Pa×s	464.20	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.67]	kPa	[366.32; 515.59]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.51851e+01
Coefficient B			-4.37027e+03
Coefficient C			-7.29640e+01
Temperature range, min.			366.32
Temperature range, max.			515.59
Pvap	1.33	kPa	366.32	Calculated Property
Pvap	2.96	kPa	382.91	Calculated Property
Pvap	6.06	kPa	399.49	Calculated Property
Pvap	11.56	kPa	416.08	Calculated Property
Pvap	20.81	kPa	432.66	Calculated Property
Pvap	35.54	kPa	449.25	Calculated Property
Pvap	58.04	kPa	465.83	Calculated Property
Pvap	91.08	kPa	482.42	Calculated Property
Pvap	137.99	kPa	499.00	Calculated Property
Pvap	202.67	kPa	515.59	Calculated Property

Similar Compounds

Find more compounds similar to 5-Decanol.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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