Chemical Properties of 3-Hexene, (Z)- (CAS 7642-09-3)

InChI

InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5-

InChI Key

ZQDPJFUHLCOCRG-WAYWQWQTSA-N

Formula

C6H12

SMILES

CCC=CCC

Molecular Weight¹

84.16

CAS

7642-09-3

Other Names

• (Z)-3-C6H12
• (Z)-3-HEXENE
• CIS-3-HEXENE

• ω : Acentric Factor.
• AP : Aniline Point (K).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• μ : Dipole Moment (debye).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_c,grossH : Heat of Combustion, Gross form (kJ/mol).
• Δ_c,netH : Heat of Combustion, Net Form (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (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).
• n₀ : Refractive Index.
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• γ : Surface Tension (N/m).
• 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).
• Z_c : Critical Compressibility.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.2250		KDB
AP	300.150	K	KDB
μ	0.30	debye	KDB
ΔfG°	83.07	kJ/mol	KDB
Δc,grossH	3997.18	kJ/mol	KDB
Δc,netH	3733.090	kJ/mol	KDB
ΔfH°gas	[-48.20; -45.90]	kJ/mol
ΔfH°gas	-47.65	kJ/mol	KDB
ΔfH°gas	-45.90 ± 0.70	kJ/mol	NIST
ΔfH°gas	-48.20 ± 1.40	kJ/mol	NIST
ΔfH°gas	-47.40	kJ/mol	NIST
ΔfH°gas	-46.90 ± 0.80	kJ/mol	NIST
ΔfH°gas	-48.00 ± 1.40	kJ/mol	NIST
ΔfH°liquid	[-79.40; -77.10]	kJ/mol
ΔfH°liquid	-77.10 ± 0.70	kJ/mol	NIST
ΔfH°liquid	-79.40 ± 1.40	kJ/mol	NIST
ΔfH°liquid	-78.07 ± 0.84	kJ/mol	NIST
ΔfH°liquid	-79.20 ± 1.40	kJ/mol	NIST
ΔfusH°	11.50	kJ/mol	Joback Calculated Property
ΔvapH°	[31.30; 31.30]	kJ/mol
ΔvapH°	31.30	kJ/mol	NIST
ΔvapH°	31.30	kJ/mol	NIST
ΔvapH°	31.30	kJ/mol	NIST
ΔvapH°	31.30	kJ/mol	NIST
IE	[8.95; 9.15]	eV
IE	8.95 ± 0.01	eV	NIST
IE	9.15 ± 0.01	eV	NIST
log10WS	-2.19		Crippen Calculated Property
logPoct/wat	2.363		Crippen Calculated Property
McVol	91.100	ml/mol	McGowan Calculated Property
Pc	3280.00	kPa	KDB
Inp	[591.50; 607.90]
Inp	602.20		NIST
Inp	592.10		NIST
Inp	593.00		NIST
Inp	593.00		NIST
Inp	602.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	602.40		NIST
Inp	602.70		NIST
Inp	592.80		NIST
Inp	593.10		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	602.00		NIST
Inp	602.00		NIST
Inp	602.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	607.90		NIST
Inp	607.90		NIST
Inp	607.90		NIST
Inp	607.90		NIST
Inp	607.90		NIST
Inp	607.90		NIST
Inp	602.30		NIST
Inp	602.90		NIST
Inp	603.50		NIST
Inp	604.20		NIST
Inp	604.90		NIST
Inp	605.60		NIST
Inp	604.80		NIST
Inp	604.50		NIST
Inp	603.60		NIST
Inp	602.90		NIST
Inp	602.20		NIST
Inp	601.40		NIST
Inp	593.00		NIST
Inp	593.00		NIST
Inp	592.20		NIST
Inp	593.00		NIST
Inp	593.00		NIST
Inp	591.50		NIST
Inp	593.00		NIST
Inp	594.00		NIST
Inp	593.00		NIST
Inp	595.80		NIST
Inp	592.70		NIST
Inp	593.00		NIST
Inp	593.70		NIST
Inp	593.00		NIST
Inp	593.00		NIST
Inp	592.00		NIST
Inp	593.00		NIST
Inp	594.00		NIST
Inp	594.00		NIST
Inp	593.00		NIST
Inp	593.00		NIST
Inp	603.75		NIST
Inp	604.00		NIST
Inp	601.60		NIST
Inp	602.19		NIST
Inp	602.28		NIST
Inp	602.00		NIST
Inp	592.20		NIST
Inp	592.00		NIST
Inp	593.00		NIST
Inp	604.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
Inp	593.00		NIST
Inp	604.00		NIST
Inp	603.00		NIST
Inp	603.00		NIST
I	[660.00; 660.10]
I	660.00		NIST
I	660.00		NIST
I	660.10		NIST
I	660.10		NIST
I	660.10		NIST
I	660.10		NIST
Tboil	[339.60; 343.80]	K
Tboil	339.60	K	KDB
Tboil	339.60	K	NIST
Tboil	339.60 ± 0.40	K	NIST
Tboil	339.63 ± 0.30	K	NIST
Tboil	339.65 ± 0.50	K	NIST
Tboil	339.67 ± 0.20	K	NIST
Tboil	339.66 ± 0.20	K	NIST
Tboil	339.71 ± 0.50	K	NIST
Tboil	339.79 ± 0.50	K	NIST
Tboil	339.79 ± 0.30	K	NIST
Tboil	Outlier 343.80 ± 1.50	K	NIST
Tboil	339.70 ± 0.50	K	NIST
Tboil	339.80 ± 0.30	K	NIST
Tboil	340.15 ± 0.30	K	NIST
Tboil	340.05 ± 0.20	K	NIST
Tc	[510.20; 517.00]	K
Tc	517.00	K	KDB
Tc	510.20	K	Gas-Liq...
Tfus	[133.51; 138.15]	K
Tfus	135.30	K	KDB
Tfus	134.70 ± 1.00	K	NIST
Tfus	134.70 ± 1.00	K	NIST
Tfus	135.27 ± 0.20	K	NIST
Tfus	134.85 ± 0.30	K	NIST
Tfus	133.51 ± 0.50	K	NIST
Tfus	138.00 ± 2.00	K	NIST
Tfus	138.15 ± 1.50	K	NIST
Vc	0.350	m3/kmol	KDB
Zc	0.2670640		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[145.03; 200.78]	J/mol×K	[340.84; 513.19]
Cp,gas	145.03	J/mol×K	340.84	Joback Calculated Property
Cp,gas	155.37	J/mol×K	369.56	Joback Calculated Property
Cp,gas	165.27	J/mol×K	398.29	Joback Calculated Property
Cp,gas	174.75	J/mol×K	427.01	Joback Calculated Property
Cp,gas	183.82	J/mol×K	455.74	Joback Calculated Property
Cp,gas	192.49	J/mol×K	484.46	Joback Calculated Property
Cp,gas	200.78	J/mol×K	513.19	Joback Calculated Property
η	[0.0001858; 0.0040974]	Pa×s	[152.30; 340.84]
η	0.0040974	Pa×s	152.30	Joback Calculated Property
η	0.0015745	Pa×s	183.72	Joback Calculated Property
η	0.0008000	Pa×s	215.15	Joback Calculated Property
η	0.0004831	Pa×s	246.57	Joback Calculated Property
η	0.0003269	Pa×s	277.99	Joback Calculated Property
η	0.0002395	Pa×s	309.42	Joback Calculated Property
η	0.0001858	Pa×s	340.84	Joback Calculated Property
ΔvapH	[28.70; 32.10]	kJ/mol	[312.00; 339.60]
ΔvapH	32.10	kJ/mol	312.00	NIST
ΔvapH	28.70	kJ/mol	339.60	KDB
n0	1.39189		298.15	KDB
ρl	680.00	kg/m3	293.00	KDB
γ	0.02	N/m	298.20	KDB

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[245.01; 363.23]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.42675e+01
Coefficient B			-2.94621e+03
Coefficient C			-3.42680e+01
Temperature range, min.			245.01
Temperature range, max.			363.23
Pvap	1.33	kPa	245.01	Calculated Property
Pvap	3.03	kPa	258.15	Calculated Property
Pvap	6.28	kPa	271.28	Calculated Property
Pvap	12.06	kPa	284.42	Calculated Property
Pvap	21.70	kPa	297.55	Calculated Property
Pvap	36.93	kPa	310.69	Calculated Property
Pvap	59.89	kPa	323.82	Calculated Property
Pvap	93.14	kPa	336.96	Calculated Property
Pvap	139.62	kPa	350.09	Calculated Property
Pvap	202.64	kPa	363.23	Calculated Property
Pvap	[3.44e-07; 3180.73]	kPa	[135.33; 509.00]	KDB Vap...
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			7.26231e+01
Coefficient B			-6.03782e+03
Coefficient C			-8.76722e+00
Coefficient D			7.50792e-06
Temperature range, min.			135.33
Temperature range, max.			509.00
Pvap	3.44e-07	kPa	135.33	Calculated Property
Pvap	1.29e-03	kPa	176.85	Calculated Property
Pvap	0.15	kPa	218.37	Calculated Property
Pvap	3.16	kPa	259.89	Calculated Property
Pvap	25.17	kPa	301.41	Calculated Property
Pvap	112.21	kPa	342.92	Calculated Property
Pvap	346.07	kPa	384.44	Calculated Property
Pvap	837.96	kPa	425.96	Calculated Property
Pvap	1724.94	kPa	467.48	Calculated Property
Pvap	3180.73	kPa	509.00	Calculated Property

Similar Compounds

Find more compounds similar to 3-Hexene, (Z)-.

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Crippen Method
• Gas-Liquid Critical Temperatures of Some Alkenes, Amines, and Cyclic Hydrocarbons
• Joback Method
• KDB
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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