Chemical Properties of 5-Pentylcyclohexa-1,3-diene (CAS 56318-84-4)

InChI

InChI=1S/C11H18/c1-2-3-5-8-11-9-6-4-7-10-11/h4,6-7,9,11H,2-3,5,8,10H2,1H3

InChI Key

PPCHPNONKYLBQT-UHFFFAOYSA-N

Formula

C11H18

SMILES

CCCCCC1C=CC=CC1

Molecular Weight¹

150.26

CAS

56318-84-4

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

Physical Properties

Property	Value	Unit	Source
ΔfusH°	18.52	kJ/mol	Joback Calculated Property
IE	8.37	eV	Relay (1.0) Calculated Property
logPoct/wat	3.699		Crippen Calculated Property
McVol	146.390	ml/mol	McGowan Calculated Property
Inp	[1161.10; 1161.10]
Inp	1161.10		NIST
Inp	1161.10		NIST
Tboil	460.54	K	Relay (1.0) Calculated Property

Cheméo can also estimate 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, 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	[315.04; 409.80]	J/mol×K	[468.95; 667.36]
Cp,gas	315.04	J/mol×K	468.95	Joback Calculated Property
Cp,gas	333.05	J/mol×K	502.02	Joback Calculated Property
Cp,gas	350.13	J/mol×K	535.09	Joback Calculated Property
Cp,gas	366.31	J/mol×K	568.15	Joback Calculated Property
Cp,gas	381.63	J/mol×K	601.22	Joback Calculated Property
Cp,gas	396.12	J/mol×K	634.29	Joback Calculated Property
Cp,gas	409.80	J/mol×K	667.36	Joback Calculated Property
η	[0.0002406; 0.0049179]	Pa×s	[222.63; 468.95]
η	0.0049179	Pa×s	222.63	Joback Calculated Property
η	0.0020107	Pa×s	263.68	Joback Calculated Property
η	0.0010461	Pa×s	304.74	Joback Calculated Property
η	0.0006356	Pa×s	345.79	Joback Calculated Property
η	0.0004292	Pa×s	386.84	Joback Calculated Property
η	0.0003126	Pa×s	427.90	Joback Calculated Property
η	0.0002406	Pa×s	468.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-Pentylcyclohexa-1,3-diene.

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.
These property values are available through the Cheméo API. A free account gives you an access key.