Chemical Properties of Furan, 2-ethyltetrahydro- (CAS 1003-30-1)

InChI

InChI=1S/C6H12O/c1-2-6-4-3-5-7-6/h6H,2-5H2,1H3

InChI Key

IHMXVSZXHFTOFN-UHFFFAOYSA-N

Formula

C6H12O

SMILES

CCC1CCCO1

Molecular Weight¹

100.16

CAS

1003-30-1

Other Names

• 2-Ethyl-tetrahydrofuran

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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
ΔfH°gas	-198.06	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	13.21	kJ/mol	Joback Calculated Property
ΔvapH°	39.17	kJ/mol	Relay (1.0) Calculated Property
IE	9.39	eV	Relay (1.0) Calculated Property
log10WS	-0.66		Relay (1.0) Calculated Property
logPoct/wat	1.575		Crippen Calculated Property
McVol	90.410	ml/mol	McGowan Calculated Property
Pc	3796.32	kPa	Joback Calculated Property
Inp	[768.00; 768.00]
Inp	768.00		NIST
Inp	768.00		NIST
Inp	768.00		NIST
Tboil	[378.15; 380.15]	K
Tboil	378.15 ± 0.50	K	NIST
Tboil	380.15 ± 3.00	K	NIST
Tc	578.81	K	Relay (1.0) Calculated Property
Tfus	166.15	K	Relay (1.0) Calculated Property
Vc	0.335	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate 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	[116.90; 331.69]	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			-4.57290e+01
Coefficient B			7.02520e-01
Coefficient C			-4.16100e-04
Coefficient D			9.10000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	116.90	J/mol×K	273.00	Calculated Property
Cp,gas	154.76	J/mol×K	353.78	Calculated Property
Cp,gas	188.45	J/mol×K	434.56	Calculated Property
Cp,gas	218.25	J/mol×K	515.33	Calculated Property
Cp,gas	244.47	J/mol×K	596.11	Calculated Property
Cp,gas	267.37	J/mol×K	676.89	Calculated Property
Cp,gas	287.26	J/mol×K	757.67	Calculated Property
Cp,gas	304.42	J/mol×K	838.44	Calculated Property
Cp,gas	319.13	J/mol×K	919.22	Calculated Property
Cp,gas	331.69	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0044740; 0.0003054]	Pa×s	[194.85; 402.82]	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			-1.06092e+01
Coefficient B			1.01317e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			194.85
Temperature range, max.			402.82
η	0.0044740	Pa×s	194.85	Calculated Property
η	0.0025780	Pa×s	217.96	Calculated Property
η	0.0016511	Pa×s	241.07	Calculated Property
η	0.0011431	Pa×s	264.17	Calculated Property
η	0.0008397	Pa×s	287.28	Calculated Property
η	0.0006458	Pa×s	310.39	Calculated Property
η	0.0005151	Pa×s	333.50	Calculated Property
η	0.0004230	Pa×s	356.60	Calculated Property
η	0.0003559	Pa×s	379.71	Calculated Property
η	0.0003054	Pa×s	402.82	Calculated Property

Similar Compounds

Find more compounds similar to Furan, 2-ethyltetrahydro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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