Chemical Properties of 1-Tricosanol (CAS 3133-01-5)

InChI

InChI=1S/C23H48O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24/h24H,2-23H2,1H3

InChI Key

FPLNRAYTBIFSFW-UHFFFAOYSA-N

Formula

C23H48O

SMILES

CCCCCCCCCCCCCCCCCCCCCCCO

Molecular Weight¹

340.63

CAS

3133-01-5

Other Names

• Tricosanol
• Tricosyl alcohol
• n-Tricosanol
• tricosan-1-ol

• 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).
• P_vap : Vapor 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	1.2381		Relay (1.0) Calculated Property
ΔfG°	5.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-683.62	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	59.41	kJ/mol	Joback Calculated Property
ΔvapH°	147.92	kJ/mol	Relay (1.0) Calculated Property
IE	10.24	eV	Relay (1.0) Calculated Property
log10WS	-8.38		Relay (1.0) Calculated Property
logPoct/wat	8.191		Crippen Calculated Property
McVol	340.800	ml/mol	McGowan Calculated Property
Pc	899.64	kPa	Joback Calculated Property
Inp	[2478.00; 2577.00]
Inp	2577.00		NIST
Inp	2577.00		NIST
Inp	2478.00		NIST
Inp	2478.00		NIST
Tboil	631.18	K	Relay (1.0) Calculated Property
Tc	814.54	K	Relay (1.0) Calculated Property
Tfus	341.73	K	Relay (1.0) Calculated Property
Vc	1.355	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[505.90; 1224.59]	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			-1.27280e+01
Coefficient B			2.22282e+00
Coefficient C			-1.25780e-03
Coefficient D			2.72300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	505.90	J/mol×K	273.00	Calculated Property
Cp,gas	628.29	J/mol×K	353.78	Calculated Property
Cp,gas	738.03	J/mol×K	434.56	Calculated Property
Cp,gas	836.00	J/mol×K	515.33	Calculated Property
Cp,gas	923.04	J/mol×K	596.11	Calculated Property
Cp,gas	1000.03	J/mol×K	676.89	Calculated Property
Cp,gas	1067.81	J/mol×K	757.67	Calculated Property
Cp,gas	1127.26	J/mol×K	838.44	Calculated Property
Cp,gas	1179.23	J/mol×K	919.22	Calculated Property
Cp,gas	1224.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0018613; 0.0000264]	Pa×s	[409.79; 701.44]	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			-1.65252e+01
Coefficient B			4.19571e+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.			409.79
Temperature range, max.			701.44
η	0.0018613	Pa×s	409.79	Calculated Property
η	0.0008789	Pa×s	442.20	Calculated Property
η	0.0004598	Pa×s	474.60	Calculated Property
η	0.0002613	Pa×s	507.01	Calculated Property
η	0.0001590	Pa×s	539.41	Calculated Property
η	0.0001023	Pa×s	571.82	Calculated Property
η	0.0000690	Pa×s	604.22	Calculated Property
η	0.0000485	Pa×s	636.63	Calculated Property
η	0.0000352	Pa×s	669.03	Calculated Property
η	0.0000264	Pa×s	701.44	Calculated Property

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[518.20; 718.54]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.51529e+01
Coefficient B			-5.83402e+03
Coefficient C			-1.25742e+02
Temperature range, min.			518.20
Temperature range, max.			718.54
Pvap	1.33	kPa	518.20	Calculated Property
Pvap	2.96	kPa	540.46	Calculated Property
Pvap	6.06	kPa	562.72	Calculated Property
Pvap	11.58	kPa	584.98	Calculated Property
Pvap	20.83	kPa	607.24	Calculated Property
Pvap	35.59	kPa	629.50	Calculated Property
Pvap	58.09	kPa	651.76	Calculated Property
Pvap	91.13	kPa	674.02	Calculated Property
Pvap	138.03	kPa	696.28	Calculated Property
Pvap	202.64	kPa	718.54	Calculated Property

Similar Compounds

Find more compounds similar to 1-Tricosanol.

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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