Chemical Properties of (Z),(Z)-2,4-Hexadiene (CAS 6108-61-8)

InChI

InChI=1S/C6H10/c1-3-5-6-4-2/h3-6H,1-2H3/b5-3-,6-4-

InChI Key

APPOKADJQUIAHP-GLIMQPGKSA-N

Formula

C6H10

SMILES

CC=CC=CC

Molecular Weight¹

82.14

CAS

6108-61-8

Other Names

• (2Z,4Z)-2,4-Hexadiene
• (Z),(Z)-CH3CH=CHCH=CHCH3
• (Z,Z)-2,4-HEXADIENE
• 2,4-Hexadiene, (Z,Z)-
• CIS,CIS-2,4-HEXADIENE
• cis-2,cis-4-Hexadiene

• 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
ΔfG°	160.08	kJ/mol	Joback Calculated Property
ΔfH°gas	52.00 ± 2.00	kJ/mol	NIST
ΔfusH°	11.70	kJ/mol	Joback Calculated Property
ΔvapH°	28.87	kJ/mol	Joback Calculated Property
IE	[8.18; 8.27]	eV
IE	8.18 ± 0.02	eV	NIST
IE	8.27	eV	NIST
log10WS	-2.04		Crippen Calculated Property
logPoct/wat	2.139		Crippen Calculated Property
McVol	86.800	ml/mol	McGowan Calculated Property
Pc	3501.28	kPa	Joback Calculated Property
Inp	[646.00; 661.30]
Inp	661.00		NIST
Inp	660.40		NIST
Inp	661.30		NIST
Inp	646.00		NIST
Tboil	358.08 ± 0.20	K	NIST
Tc	527.01	K	Joback Calculated Property
Tfus	203.78 ± 0.40	K	NIST
Vc	0.332	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[131.24; 184.66]	J/mol×K	[345.00; 527.01]
Cp,gas	131.24	J/mol×K	345.00	Joback Calculated Property
Cp,gas	141.42	J/mol×K	375.33	Joback Calculated Property
Cp,gas	151.05	J/mol×K	405.67	Joback Calculated Property
Cp,gas	160.17	J/mol×K	436.00	Joback Calculated Property
Cp,gas	168.79	J/mol×K	466.34	Joback Calculated Property
Cp,gas	176.95	J/mol×K	496.67	Joback Calculated Property
Cp,gas	184.66	J/mol×K	527.01	Joback Calculated Property
η	[0.0001508; 0.0037874]	Pa×s	[147.22; 345.00]
η	0.0037874	Pa×s	147.22	Joback Calculated Property
η	0.0013538	Pa×s	180.18	Joback Calculated Property
η	0.0006652	Pa×s	213.15	Joback Calculated Property
η	0.0003954	Pa×s	246.11	Joback Calculated Property
η	0.0002657	Pa×s	279.07	Joback Calculated Property
η	0.0001943	Pa×s	312.04	Joback Calculated Property
η	0.0001508	Pa×s	345.00	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[256.76; 384.26]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.34840e+01
Coefficient B			-2.73711e+03
Coefficient C			-4.93500e+01
Temperature range, min.			256.76
Temperature range, max.			384.26
Pvap	1.33	kPa	256.76	Calculated Property
Pvap	3.10	kPa	270.93	Calculated Property
Pvap	6.51	kPa	285.09	Calculated Property
Pvap	12.57	kPa	299.26	Calculated Property
Pvap	22.63	kPa	313.43	Calculated Property
Pvap	38.36	kPa	327.59	Calculated Property
Pvap	61.78	kPa	341.76	Calculated Property
Pvap	95.21	kPa	355.93	Calculated Property
Pvap	141.23	kPa	370.09	Calculated Property
Pvap	202.63	kPa	384.26	Calculated Property

Similar Compounds

Find more compounds similar to (Z),(Z)-2,4-Hexadiene.

Sources

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

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