Chemical Properties of 1-(1-Ethenyl)-cis-2-butyl-cyclopropane

InChI

InChI=1S/C9H16/c1-3-5-6-9-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3/t8-,9+/m1/s1

InChI Key

OROUOQQBLPHIHQ-BDAKNGLRSA-N

Formula

C9H16

SMILES

C=CC1CC1CCCC

Molecular Weight¹

124.22

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	16.99	kJ/mol	Joback Calculated Property
logPoct/wat	2.999		Crippen Calculated Property
McVol	122.510	ml/mol	McGowan Calculated Property
Inp	[886.30; 889.00]
Inp	889.00		NIST
Inp	886.30		NIST
Inp	889.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[165.42; 441.53]	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			-5.25870e+01
Coefficient B			9.63220e-01
Coefficient C			-6.53500e-04
Coefficient D			1.84400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	165.42	J/mol×K	273.00	Calculated Property
Cp,gas	214.55	J/mol×K	353.78	Calculated Property
Cp,gas	257.71	J/mol×K	434.56	Calculated Property
Cp,gas	295.48	J/mol×K	515.33	Calculated Property
Cp,gas	328.44	J/mol×K	596.11	Calculated Property
Cp,gas	357.18	J/mol×K	676.89	Calculated Property
Cp,gas	382.27	J/mol×K	757.67	Calculated Property
Cp,gas	404.30	J/mol×K	838.44	Calculated Property
Cp,gas	423.86	J/mol×K	919.22	Calculated Property
Cp,gas	441.53	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007831; 0.0003465]	Pa×s	[203.13; 408.87]	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			-8.77289e+00
Coefficient B			3.29190e+02
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.			203.13
Temperature range, max.			408.87
η	0.0007831	Pa×s	203.13	Calculated Property
η	0.0006647	Pa×s	225.99	Calculated Property
η	0.0005814	Pa×s	248.85	Calculated Property
η	0.0005202	Pa×s	271.71	Calculated Property
η	0.0004735	Pa×s	294.57	Calculated Property
η	0.0004369	Pa×s	317.43	Calculated Property
η	0.0004075	Pa×s	340.29	Calculated Property
η	0.0003834	Pa×s	363.15	Calculated Property
η	0.0003634	Pa×s	386.01	Calculated Property
η	0.0003465	Pa×s	408.87	Calculated Property

Similar Compounds

Find more compounds similar to 1-(1-Ethenyl)-cis-2-butyl-cyclopropane.

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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