Chemical Properties of 3-Ethyl-5-hexen-3-ol (CAS 1907-46-6)

InChI

InChI=1S/C8H16O/c1-4-7-8(9,5-2)6-3/h4,9H,1,5-7H2,2-3H3

InChI Key

ZNPHYMBSDNDCCM-UHFFFAOYSA-N

Formula

C8H16O

SMILES

C=CCC(O)(CC)CC

Molecular Weight¹

128.21

CAS

1907-46-6

Other Names

• 5-Hexen-3-ol, 3-ethyl-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[176.42; 423.68]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-2.65570e+01
Coefficient B			9.03640e-01
Coefficient C			-6.36500e-04
Coefficient D			1.83100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	176.42	J/mol×K	273.00	Calculated Property
Cp,gas	221.57	J/mol×K	353.78	Calculated Property
Cp,gas	260.95	J/mol×K	434.56	Calculated Property
Cp,gas	295.14	J/mol×K	515.33	Calculated Property
Cp,gas	324.72	J/mol×K	596.11	Calculated Property
Cp,gas	350.26	J/mol×K	676.89	Calculated Property
Cp,gas	372.35	J/mol×K	757.67	Calculated Property
Cp,gas	391.56	J/mol×K	838.44	Calculated Property
Cp,gas	408.48	J/mol×K	919.22	Calculated Property
Cp,gas	423.68	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0700944; 0.0002450]	Pa×s	[241.40; 448.29]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.49143e+01
Coefficient B			2.95869e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			241.40
Temperature range, max.			448.29
η	0.0700944	Pa×s	241.40	Calculated Property
η	0.0241471	Pa×s	264.39	Calculated Property
η	0.0098649	Pa×s	287.38	Calculated Property
η	0.0046016	Pa×s	310.36	Calculated Property
η	0.0023845	Pa×s	333.35	Calculated Property
η	0.0013450	Pa×s	356.34	Calculated Property
η	0.0008132	Pa×s	379.33	Calculated Property
η	0.0005208	Pa×s	402.32	Calculated Property
η	0.0003500	Pa×s	425.31	Calculated Property
η	0.0002450	Pa×s	448.29	Calculated Property

Similar Compounds

Find more compounds similar to 3-Ethyl-5-hexen-3-ol.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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