Chemical Properties of 1-Heptylcyclohexene (CAS 15232-86-7)

InChI

InChI=1S/C13H24/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h11H,2-10,12H2,1H3

InChI Key

XDUFGMTUKHRHSO-UHFFFAOYSA-N

Formula

C13H24

SMILES

CCCCCCCC1=CCCCC1

Molecular Weight¹

180.33

CAS

15232-86-7

Other Names

• Cyclohexene,1-heptyl-
• 1-Heptyl-1-cyclohexene

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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.
• I : 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
ΔfG°	111.07	kJ/mol	Joback Calculated Property
ΔfH°gas	-190.68	kJ/mol	Joback Calculated Property
ΔfusH°	21.02	kJ/mol	Joback Calculated Property
ΔvapH°	46.22	kJ/mol	Joback Calculated Property
IE	8.37 ± 0.02	eV	NIST
log10WS	-5.01		Crippen Calculated Property
logPoct/wat	4.847		Crippen Calculated Property
McVol	178.870	ml/mol	McGowan Calculated Property
Pc	2053.03	kPa	Joback Calculated Property
Inp	[1342.00; 1344.00]
Inp	1344.00		NIST
Inp	1342.00		NIST
I	[1470.00; 1518.00]
I	1486.00		NIST
I	1498.00		NIST
I	1501.00		NIST
I	1513.00		NIST
I	Outlier 1518.00		NIST
I	1470.00		NIST
I	1477.00		NIST
I	1482.00		NIST
I	1488.00		NIST
I	1493.00		NIST
I	1499.00		NIST
I	1504.00		NIST
I	1476.80		NIST
I	1482.50		NIST
I	1488.20		NIST
I	1493.40		NIST
I	1499.10		NIST
I	1503.90		NIST
I	1486.00		NIST
Tboil	525.20	K	Joback Calculated Property
Tc	718.22	K	Joback Calculated Property
Tfus	261.17	K	Joback Calculated Property
Vc	0.683	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[428.76; 532.88]	J/mol×K	[525.20; 718.22]
Cp,gas	428.76	J/mol×K	525.20	Joback Calculated Property
Cp,gas	448.44	J/mol×K	557.37	Joback Calculated Property
Cp,gas	467.15	J/mol×K	589.54	Joback Calculated Property
Cp,gas	484.92	J/mol×K	621.71	Joback Calculated Property
Cp,gas	501.78	J/mol×K	653.88	Joback Calculated Property
Cp,gas	517.75	J/mol×K	686.05	Joback Calculated Property
Cp,gas	532.88	J/mol×K	718.22	Joback Calculated Property
η	[0.0001931; 0.0057111]	Pa×s	[261.17; 525.20]
η	0.0057111	Pa×s	261.17	Joback Calculated Property
η	0.0021619	Pa×s	305.18	Joback Calculated Property
η	0.0010454	Pa×s	349.18	Joback Calculated Property
η	0.0005948	Pa×s	393.19	Joback Calculated Property
η	0.0003791	Pa×s	437.19	Joback Calculated Property
η	0.0002624	Pa×s	481.20	Joback Calculated Property
η	0.0001931	Pa×s	525.20	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1-Heptylcyclohexene.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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