Chemical Properties of trans-2-Penten-1-ol (CAS 1576-96-1)

InChI

InChI=1S/C5H10O/c1-2-3-4-5-6/h3-4,6H,2,5H2,1H3/b4-3+

InChI Key

BTSIZIIPFNVMHF-ONEGZZNKSA-N

Formula

C5H10O

SMILES

CCC=CCO

Molecular Weight¹

86.13

CAS

1576-96-1

• ω : Acentric Factor.
• 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 : 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
ω	0.5241		Relay (1.0) Calculated Property
ΔfG°	-65.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-216.53	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.00	kJ/mol	Joback Calculated Property
ΔvapH°	55.87	kJ/mol	Relay (1.0) Calculated Property
IE	9.08	eV	Relay (1.0) Calculated Property
log10WS	-0.47		Relay (1.0) Calculated Property
logPoct/wat	0.945		Crippen Calculated Property
McVol	82.880	ml/mol	McGowan Calculated Property
Pc	4140.93	kPa	Joback Calculated Property
I	[1314.00; 1335.00]
I	1325.00		NIST
I	1335.00		NIST
I	1314.00		NIST
Tboil	404.75	K	Relay (1.0) Calculated Property
Tc	588.39	K	Relay (1.0) Calculated Property
Tfus	196.68	K	Relay (1.0) Calculated Property
Vc	0.292	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[154.30; 197.11]	J/mol×K	[410.14; 579.75]
Cp,gas	154.30	J/mol×K	410.14	Joback Calculated Property
Cp,gas	162.28	J/mol×K	438.41	Joback Calculated Property
Cp,gas	169.90	J/mol×K	466.68	Joback Calculated Property
Cp,gas	177.18	J/mol×K	494.94	Joback Calculated Property
Cp,gas	184.13	J/mol×K	523.21	Joback Calculated Property
Cp,gas	190.77	J/mol×K	551.48	Joback Calculated Property
Cp,gas	197.11	J/mol×K	579.75	Joback Calculated Property
η	[0.0002330; 0.1185690]	Pa×s	[201.85; 410.14]
η	0.1185690	Pa×s	201.85	Joback Calculated Property
η	0.0195828	Pa×s	236.56	Joback Calculated Property
η	0.0051279	Pa×s	271.28	Joback Calculated Property
η	0.0018199	Pa×s	306.00	Joback Calculated Property
η	0.0007977	Pa×s	340.71	Joback Calculated Property
η	0.0004073	Pa×s	375.42	Joback Calculated Property
η	0.0002330	Pa×s	410.14	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.64]	kPa	[313.61; 415.60]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.80288e+01
Coefficient B			-4.58015e+03
Coefficient C			-5.54500e+01
Temperature range, min.			313.61
Temperature range, max.			415.60
Pvap	1.33	kPa	313.61	Calculated Property
Pvap	2.81	kPa	324.94	Calculated Property
Pvap	5.58	kPa	336.27	Calculated Property
Pvap	10.50	kPa	347.61	Calculated Property
Pvap	18.86	kPa	358.94	Calculated Property
Pvap	32.47	kPa	370.27	Calculated Property
Pvap	53.83	kPa	381.60	Calculated Property
Pvap	86.26	kPa	392.94	Calculated Property
Pvap	134.06	kPa	404.27	Calculated Property
Pvap	202.64	kPa	415.60	Calculated Property

Similar Compounds

Find more compounds similar to trans-2-Penten-1-ol.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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