Chemical Properties of Cyclohexene,3-propyl- (CAS 3983-06-0)

InChI

InChI=1S/C9H16/c1-2-6-9-7-4-3-5-8-9/h4,7,9H,2-3,5-6,8H2,1H3

InChI Key

XWIMYKYUBWUJOH-UHFFFAOYSA-N

Formula

C9H16

SMILES

CCCC1C=CCCC1

Molecular Weight¹

124.22

CAS

3983-06-0

Other Names

• 3-Propylcyclohexene-1
• 3-Propyl-1-cyclohexene

• 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).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-75.72	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	12.12	kJ/mol	Joback Calculated Property
IE	8.80 ± 0.01	eV	NIST
logPoct/wat	3.143		Crippen Calculated Property
McVol	122.510	ml/mol	McGowan Calculated Property
Inp	[938.00; 986.00]
Inp	938.00		NIST
Inp	944.00		NIST
Inp	948.00		NIST
Inp	977.00		NIST
Inp	Outlier 986.00		NIST
Inp	938.50		NIST
Inp	944.40		NIST
Inp	938.00		NIST
Inp	944.00		NIST
I	[1070.80; 1097.00]
I	1097.00		NIST
I	1075.00		NIST
I	1085.00		NIST
I	1082.00		NIST
I	1087.00		NIST
I	1092.00		NIST
I	1071.00		NIST
I	1076.00		NIST
I	1082.20		NIST
I	1087.20		NIST
I	1091.80		NIST
I	1070.80		NIST
I	1076.40		NIST
I	1097.00		NIST
I	1097.00		NIST
I	1075.00		NIST
I	1085.40		NIST
I	1097.00		NIST
I	1075.00		NIST
I	1085.40		NIST
Tboil	423.83	K	Relay (1.0) Calculated Property
Tfus	181.22	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[241.52; 333.24]	J/mol×K	[424.23; 625.32]
Cp,gas	241.52	J/mol×K	424.23	Joback Calculated Property
Cp,gas	258.87	J/mol×K	457.74	Joback Calculated Property
Cp,gas	275.37	J/mol×K	491.26	Joback Calculated Property
Cp,gas	291.03	J/mol×K	524.77	Joback Calculated Property
Cp,gas	305.88	J/mol×K	558.29	Joback Calculated Property
Cp,gas	319.94	J/mol×K	591.80	Joback Calculated Property
Cp,gas	333.24	J/mol×K	625.32	Joback Calculated Property
η	[0.0002620; 0.0061457]	Pa×s	[199.33; 424.23]
η	0.0061457	Pa×s	199.33	Joback Calculated Property
η	0.0023957	Pa×s	236.81	Joback Calculated Property
η	0.0012081	Pa×s	274.30	Joback Calculated Property
η	0.0007183	Pa×s	311.78	Joback Calculated Property
η	0.0004774	Pa×s	349.26	Joback Calculated Property
η	0.0003435	Pa×s	386.75	Joback Calculated Property
η	0.0002620	Pa×s	424.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexene,3-propyl-.

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

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.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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