Chemical Properties of 1,3-Pentadiene, (Z)- (CAS 1574-41-0)

InChI

InChI=1S/C5H8/c1-3-5-4-2/h3-5H,1H2,2H3/b5-4-

InChI Key

PMJHHCWVYXUKFD-PLNGDYQASA-N

Formula

C5H8

SMILES

C=CC=CC

Molecular Weight¹

68.12

CAS

1574-41-0

Other Names

• (Z)-1,3-PENTADIENE
• (Z)-CH2=CHCH=CHCH3
• (Z)-penta-1,3-diene
• 1,cis-3-Pentadiene
• CIS-1,3-PENTADIENE
• CIS-1-METHYLBUTADIENE
• CIS-PIPERYLENE
• Pentadiene-1,3, cis-

• Δ_cH°_gas : Standard gas enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase 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_fusH : Enthalpy of fusion at a given temperature (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).
• I_np : Non-polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_gas : Molar entropy at standard conditions (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°gas	-3193.60 ± 0.88	kJ/mol	NIST
ΔfG°	159.28	kJ/mol	Joback Calculated Property
ΔfH°gas	82.72 ± 0.92	kJ/mol	NIST
ΔfusH°	7.63	kJ/mol	Joback Calculated Property
ΔvapH°	28.30	kJ/mol	NIST
IE	[8.59; 8.67]	eV
IE	8.62 ± 0.03	eV	NIST
IE	8.64	eV	NIST
IE	8.67 ± 0.02	eV	NIST
IE	8.59	eV	NIST
IE	8.63	eV	NIST
IE	8.60	eV	NIST
IE	8.60	eV	NIST
log10WS	-1.62		Crippen Calculated Property
logPoct/wat	1.748		Crippen Calculated Property
McVol	72.710	ml/mol	McGowan Calculated Property
Pc	3886.79	kPa	Joback Calculated Property
Inp	[510.00; 541.20]
Inp	524.00		NIST
Inp	537.00		NIST
Inp	Outlier 510.00		NIST
Inp	525.00		NIST
Inp	524.80		NIST
Inp	524.40		NIST
Inp	525.10		NIST
Inp	536.10		NIST
Inp	522.80		NIST
Inp	524.00		NIST
Inp	525.00		NIST
Inp	527.00		NIST
Inp	527.00		NIST
Inp	541.20		NIST
Inp	Outlier 510.50		NIST
Inp	536.00		NIST
Inp	524.00		NIST
Inp	536.00		NIST
Inp	536.00		NIST
Inp	532.00		NIST
Inp	536.00		NIST
S°gas	322.80	J/mol×K	NIST
S°liquid	233.25	J/mol×K	NIST
Tboil	[316.00; 317.30]	K
Tboil	317.30	K	NIST
Tboil	317.18 ± 0.40	K	NIST
Tboil	317.20 ± 0.40	K	NIST
Tboil	316.65 ± 1.00	K	NIST
Tboil	316.00 ± 2.00	K	NIST
Tc	490.29	K	Joback Calculated Property
Tfus	[131.57; 132.33]	K
Tfus	132.31	K	KDB
Tfus	132.31 ± 0.04	K	NIST
Tfus	132.31 ± 0.03	K	NIST
Tfus	132.33 ± 0.02	K	NIST
Tfus	131.57 ± 0.50	K	NIST
Ttriple	132.35 ± 0.05	K	NIST
Vc	0.277	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[100.21; 143.95]	J/mol×K	[314.64; 490.29]
T(K) Ideal gas heat capacity (J/mol×K) 100 110 120 130 140 350 400 450
Cp,gas	100.21	J/mol×K	314.64	Joback Calculated Property
Cp,gas	108.47	J/mol×K	343.91	Joback Calculated Property
Cp,gas	116.31	J/mol×K	373.19	Joback Calculated Property
Cp,gas	123.76	J/mol×K	402.46	Joback Calculated Property
Cp,gas	130.84	J/mol×K	431.74	Joback Calculated Property
Cp,gas	137.57	J/mol×K	461.01	Joback Calculated Property
Cp,gas	143.95	J/mol×K	490.29	Joback Calculated Property
Cp,liquid	146.57	J/mol×K	298.15	NIST
η	[0.0001562; 0.0024945]	Pa×s	[139.27; 314.64]
T(K) Dynamic viscosity (Pa×s) 0 5.00e-4 1.00e-3 1.50e-3 2.00e-3 2.50e-3 150 200 250 300
η	0.0024945	Pa×s	139.27	Joback Calculated Property
η	0.0010531	Pa×s	168.50	Joback Calculated Property
η	0.0005737	Pa×s	197.73	Joback Calculated Property
η	0.0003655	Pa×s	226.95	Joback Calculated Property
η	0.0002581	Pa×s	256.18	Joback Calculated Property
η	0.0001957	Pa×s	285.41	Joback Calculated Property
η	0.0001562	Pa×s	314.64	Joback Calculated Property
ΔfusH	[5.64; 5.64]	kJ/mol	[132.35; 132.40]
ΔfusH	5.64	kJ/mol	132.35	NIST
ΔfusH	5.64	kJ/mol	132.40	NIST
ΔfusH	5.64	kJ/mol	132.40	NIST
ΔvapH	[28.80; 31.90]	kJ/mol	[227.50; 303.50]
ΔvapH	31.90	kJ/mol	227.50	NIST
ΔvapH	31.20	kJ/mol	242.50	NIST
ΔvapH	30.10	kJ/mol	290.50	NIST
ΔvapH	28.80	kJ/mol	303.50	NIST
ΔfusS	42.60	J/mol×K	132.35	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[227.24; 340.25]	The Yaw...
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.37915e+01
Coefficient B			-2.57592e+03
Coefficient C			-3.64890e+01
Temperature range, min.			227.24
Temperature range, max.			340.25
T(K) Vapor pressure (kPa) 0 50 100 150 200 250 300
Pvap	1.33	kPa	227.24	Calculated Property
Pvap	3.07	kPa	239.80	Calculated Property
Pvap	6.41	kPa	252.35	Calculated Property
Pvap	12.36	kPa	264.91	Calculated Property
Pvap	22.24	kPa	277.47	Calculated Property
Pvap	37.77	kPa	290.02	Calculated Property
Pvap	61.00	kPa	302.58	Calculated Property
Pvap	94.36	kPa	315.14	Calculated Property
Pvap	140.57	kPa	327.69	Calculated Property
Pvap	202.63	kPa	340.25	Calculated Property
Pvap	[2.08e-06; 3762.04]	kPa	[132.35; 499.00]	KDB Vap...
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			6.03742e+01
Coefficient B			-5.30049e+03
Coefficient C			-6.85336e+00
Coefficient D			4.24873e-06
Temperature range, min.			132.35
Temperature range, max.			499.00
T(K) Vapor pressure (kPa) 0 500 1000 1500 2000 2500 3000 3500 4000 200 300 400 500
Pvap	2.08e-06	kPa	132.35	Calculated Property
Pvap	4.33e-03	kPa	173.09	Calculated Property
Pvap	0.37	kPa	213.83	Calculated Property
Pvap	6.45	kPa	254.57	Calculated Property
Pvap	45.31	kPa	295.31	Calculated Property
Pvap	183.68	kPa	336.04	Calculated Property
Pvap	522.06	kPa	376.78	Calculated Property
Pvap	1169.45	kPa	417.52	Calculated Property
Pvap	2222.53	kPa	458.26	Calculated Property
Pvap	3762.04	kPa	499.00	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Pentadiene, (Z)-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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