Chemical Properties of 2-Hexen-1-ol, (Z)- (CAS 928-94-9)

InChI

InChI=1S/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4-

InChI Key

ZCHHRLHTBGRGOT-PLNGDYQASA-N

Formula

C6H12O

SMILES

CCCC=CCO

Molecular Weight¹

100.16

CAS

928-94-9

Other Names

• (Z)-2-Hexenol
• (Z)-Hex-2-en-1-ol
• (Z)-Hex-2-ene-1-ol
• (Z)-Hex-2-enol
• Z-2-Hexen-1-ol
• cis-2-Hexen-1-ol
• cis-2-Hexenol
• cis-hex-2-en-1-ol

• 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).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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°	-56.96	kJ/mol	Joback Calculated Property
ΔfH°gas	-202.18	kJ/mol	Joback Calculated Property
ΔfusH°	15.59	kJ/mol	Joback Calculated Property
ΔvapH°	45.59	kJ/mol	Joback Calculated Property
log10WS	-1.45		Crippen Calculated Property
logPoct/wat	1.335		Crippen Calculated Property
McVol	96.970	ml/mol	McGowan Calculated Property
Pc	3673.09	kPa	Joback Calculated Property
Inp	[827.00; 885.70]
Inp	869.00		NIST
Inp	Outlier 827.00		NIST
Inp	850.00		NIST
Inp	837.00		NIST
Inp	Outlier 885.70		NIST
Inp	837.00		NIST
Inp	847.00		NIST
Inp	865.00		NIST
Inp	856.00		NIST
Inp	856.00		NIST
Inp	868.00		NIST
Inp	Outlier 827.00		NIST
Inp	856.00		NIST
Inp	856.00		NIST
Inp	855.00		NIST
Inp	855.00		NIST
Inp	855.00		NIST
Inp	855.00		NIST
Inp	863.00		NIST
Inp	847.00		NIST
Inp	845.00		NIST
Inp	846.00		NIST
Inp	866.00		NIST
Inp	872.00		NIST
Inp	870.00		NIST
Inp	862.00		NIST
Inp	875.00		NIST
Inp	854.00		NIST
Inp	868.00		NIST
Inp	Outlier 827.00		NIST
Inp	855.00		NIST
Inp	846.00		NIST
I	[1368.00; 1441.00]
I	1420.00		NIST
I	1420.00		NIST
I	1405.00		NIST
I	Outlier 1380.00		NIST
I	1401.00		NIST
I	1389.00		NIST
I	1402.00		NIST
I	1410.00		NIST
I	1399.00		NIST
I	1420.00		NIST
I	1416.00		NIST
I	1416.00		NIST
I	1405.00		NIST
I	1398.00		NIST
I	1434.00		NIST
I	Outlier 1441.00		NIST
I	1418.00		NIST
I	1417.00		NIST
I	1417.00		NIST
I	1417.00		NIST
I	1419.00		NIST
I	1403.00		NIST
I	1401.00		NIST
I	1397.00		NIST
I	1413.00		NIST
I	1417.00		NIST
I	1418.00		NIST
I	1397.00		NIST
I	1407.00		NIST
I	Outlier 1441.00		NIST
I	1411.00		NIST
I	1423.00		NIST
I	1410.00		NIST
I	1423.00		NIST
I	1412.00		NIST
I	Outlier 1375.00		NIST
I	1418.00		NIST
I	1416.00		NIST
I	1416.00		NIST
I	Outlier 1368.00		NIST
I	1420.00		NIST
I	1405.00		NIST
I	1410.00		NIST
Tboil	430.20	K	NIST
Tc	601.76	K	Joback Calculated Property
Tfus	213.12	K	Joback Calculated Property
Vc	0.370	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[191.78; 240.99]	J/mol×K	[433.02; 601.76]
Cp,gas	191.78	J/mol×K	433.02	Joback Calculated Property
Cp,gas	200.94	J/mol×K	461.14	Joback Calculated Property
Cp,gas	209.69	J/mol×K	489.27	Joback Calculated Property
Cp,gas	218.06	J/mol×K	517.39	Joback Calculated Property
Cp,gas	226.05	J/mol×K	545.51	Joback Calculated Property
Cp,gas	233.69	J/mol×K	573.64	Joback Calculated Property
Cp,gas	240.99	J/mol×K	601.76	Joback Calculated Property
η	[0.0002006; 0.0918576]	Pa×s	[213.12; 433.02]
η	0.0918576	Pa×s	213.12	Joback Calculated Property
η	0.0156415	Pa×s	249.77	Joback Calculated Property
η	0.0041899	Pa×s	286.42	Joback Calculated Property
η	0.0015133	Pa×s	323.07	Joback Calculated Property
η	0.0006726	Pa×s	359.72	Joback Calculated Property
η	0.0003473	Pa×s	396.37	Joback Calculated Property
η	0.0002006	Pa×s	433.02	Joback Calculated Property

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[328.55; 454.10]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.60167e+01
Coefficient B			-4.20816e+03
Coefficient C			-6.10100e+01
Temperature range, min.			328.55
Temperature range, max.			454.10
Pvap	1.33	kPa	328.55	Calculated Property
Pvap	2.91	kPa	342.50	Calculated Property
Pvap	5.89	kPa	356.45	Calculated Property
Pvap	11.19	kPa	370.40	Calculated Property
Pvap	20.13	kPa	384.35	Calculated Property
Pvap	34.48	kPa	398.30	Calculated Property
Pvap	56.59	kPa	412.25	Calculated Property
Pvap	89.43	kPa	426.20	Calculated Property
Pvap	136.66	kPa	440.15	Calculated Property
Pvap	202.63	kPa	454.10	Calculated Property

Similar Compounds

Find more compounds similar to 2-Hexen-1-ol, (Z)-.

Sources

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

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