Chemical Properties of 3-Decanol (CAS 1565-81-7)

InChI

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

InChI Key

ICEQLCZWZXUUIJ-UHFFFAOYSA-N

Formula

C10H22O

SMILES

CCCCCCCC(O)CC

Molecular Weight¹

158.28

CAS

1565-81-7

• 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).
• 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
ΔfG°	-105.94	kJ/mol	Joback Calculated Property
ΔfH°gas	-407.24	kJ/mol	Joback Calculated Property
ΔfusH°	22.22	kJ/mol	Joback Calculated Property
ΔvapH°	54.14	kJ/mol	Joback Calculated Property
log10WS	-3.38		Crippen 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	[1184.00; 1197.00]
Inp	1189.00		NIST
Inp	1184.00		NIST
Inp	1197.00		NIST
Inp	1188.00		NIST
I	[1563.00; 1632.00]
I	1563.00		NIST
I	1570.00		NIST
I	1632.00		NIST
I	1602.00		NIST
Tboil	519.94	K	Joback Calculated Property
Tc	[666.00; 666.11]	K
Tc	666.00 ± 1.00	K	NIST
Tc	666.10	K	NIST
Tc	666.11 ± 0.30	K	NIST
Tfus	248.28	K	Joback Calculated Property
Vc	0.643	m3/kmol	NIST

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[380.84; 454.40]	J/mol×K	[519.94; 681.25]
Cp,gas	380.84	J/mol×K	519.94	Joback Calculated Property
Cp,gas	394.36	J/mol×K	546.83	Joback Calculated Property
Cp,gas	407.36	J/mol×K	573.71	Joback Calculated Property
Cp,gas	419.85	J/mol×K	600.60	Joback Calculated Property
Cp,gas	431.84	J/mol×K	627.48	Joback Calculated Property
Cp,gas	443.35	J/mol×K	654.37	Joback Calculated Property
Cp,gas	454.40	J/mol×K	681.25	Joback Calculated Property
η	[0.0001173; 0.0660457]	Pa×s	[248.28; 519.94]
η	0.0660457	Pa×s	248.28	Joback Calculated Property
η	0.0101842	Pa×s	293.56	Joback Calculated Property
η	0.0025882	Pa×s	338.83	Joback Calculated Property
η	0.0009085	Pa×s	384.11	Joback Calculated Property
η	0.0003977	Pa×s	429.39	Joback Calculated Property
η	0.0002038	Pa×s	474.66	Joback Calculated Property
η	0.0001173	Pa×s	519.94	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[373.40; 513.15]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.60231e+01
Coefficient B			-4.68879e+03
Coefficient C			-7.54240e+01
Temperature range, min.			373.40
Temperature range, max.			513.15
Pvap	1.33	kPa	373.40	Calculated Property
Pvap	2.91	kPa	388.93	Calculated Property
Pvap	5.89	kPa	404.46	Calculated Property
Pvap	11.19	kPa	419.98	Calculated Property
Pvap	20.12	kPa	435.51	Calculated Property
Pvap	34.47	kPa	451.04	Calculated Property
Pvap	56.58	kPa	466.57	Calculated Property
Pvap	89.42	kPa	482.09	Calculated Property
Pvap	136.65	kPa	497.62	Calculated Property
Pvap	202.63	kPa	513.15	Calculated Property

Similar Compounds

Find more compounds similar to 3-Decanol.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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