Chemical Properties of Cyclopentene,1-heptyl- (CAS 4292-00-6)

InChI

InChI=1S/C12H22/c1-2-3-4-5-6-9-12-10-7-8-11-12/h10H,2-9,11H2,1H3

InChI Key

FALRQTIXQCGLJF-UHFFFAOYSA-N

Formula

C12H22

SMILES

CCCCCCCC1=CCCC1

Molecular Weight¹

166.30

CAS

4292-00-6

Other Names

• 1-Heptyl-1-cyclopentene

• 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).
• 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	-148.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	20.53	kJ/mol	Joback Calculated Property
ΔvapH°	60.53	kJ/mol	Relay (1.0) Calculated Property
IE	8.41 ± 0.03	eV	NIST
logPoct/wat	4.457		Crippen Calculated Property
McVol	164.780	ml/mol	McGowan Calculated Property
Inp	[1229.00; 1240.00]
Inp	1234.00		NIST
Inp	1240.00		NIST
Inp	1229.00		NIST
I	[1350.60; 1380.00]
I	1362.00		NIST
I	1365.00		NIST
I	1369.00		NIST
I	Outlier 1380.00		NIST
I	1351.00		NIST
I	1355.00		NIST
I	1358.00		NIST
I	1362.00		NIST
I	1366.00		NIST
I	1369.00		NIST
I	1372.00		NIST
I	1350.60		NIST
I	1354.60		NIST
I	1358.10		NIST
I	1362.20		NIST
I	1365.60		NIST
I	1368.60		NIST
I	1372.40		NIST
I	1362.00		NIST
I	1362.00		NIST
I	1355.00		NIST
I	1372.00		NIST
I	1365.60		NIST
Tboil	490.00 ± 15.00	K	NIST
Tfus	213.41	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, 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	[379.06; 475.05]	J/mol×K	[498.05; 686.68]
Cp,gas	379.06	J/mol×K	498.05	Joback Calculated Property
Cp,gas	397.16	J/mol×K	529.49	Joback Calculated Property
Cp,gas	414.38	J/mol×K	560.93	Joback Calculated Property
Cp,gas	430.74	J/mol×K	592.37	Joback Calculated Property
Cp,gas	446.29	J/mol×K	623.80	Joback Calculated Property
Cp,gas	461.04	J/mol×K	655.24	Joback Calculated Property
Cp,gas	475.05	J/mol×K	686.68	Joback Calculated Property
η	[0.0002561; 0.0042714]	Pa×s	[253.42; 498.05]
η	0.0042714	Pa×s	253.42	Joback Calculated Property
η	0.0019308	Pa×s	294.19	Joback Calculated Property
η	0.0010589	Pa×s	334.96	Joback Calculated Property
η	0.0006616	Pa×s	375.74	Joback Calculated Property
η	0.0004532	Pa×s	416.51	Joback Calculated Property
η	0.0003321	Pa×s	457.28	Joback Calculated Property
η	0.0002561	Pa×s	498.05	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclopentene,1-heptyl-.

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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