Chemical Properties of Cyclohexene,1-(2-methylpropyl)- (CAS 3983-03-7)

InChI

InChI=1S/C10H18/c1-9(2)8-10-6-4-3-5-7-10/h6,9H,3-5,7-8H2,1-2H3

InChI Key

NQIVPQHOBXSALG-UHFFFAOYSA-N

Formula

C10H18

SMILES

CC(C)CC1=CCCCC1

Molecular Weight¹

138.25

CAS

3983-03-7

Other Names

• 1-Isobutylcyclohexene-1
• 1-Isobutyl-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).
• 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
ΔfH°gas	-112.75	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	9.73	kJ/mol	Joback Calculated Property
ΔvapH°	47.10	kJ/mol	Relay (1.0) Calculated Property
IE	8.40 ± 0.01	eV	NIST
log10WS	-4.49		Relay (1.0) Calculated Property
logPoct/wat	3.533		Crippen Calculated Property
McVol	136.600	ml/mol	McGowan Calculated Property
Pc	2738.28	kPa	Joback Calculated Property
Inp	[1000.90; 1040.00]
Inp	1001.00		NIST
Inp	1005.00		NIST
Inp	1031.00		NIST
Inp	Outlier 1040.00		NIST
Inp	1000.90		NIST
Inp	1000.90		NIST
Inp	1003.00		NIST
Inp	1001.00		NIST
Inp	1000.90		NIST
Inp	1003.00		NIST
I	[1118.00; 1159.00]
I	1129.00		NIST
I	1140.00		NIST
I	1144.00		NIST
I	Outlier 1159.00		NIST
I	1118.00		NIST
I	1129.00		NIST
I	1141.40		NIST
I	1119.80		NIST
I	1130.80		NIST
I	1129.00		NIST
Tboil	447.39	K	Relay (1.0) Calculated Property
Tc	645.39	K	Relay (1.0) Calculated Property
Tfus	182.74	K	Relay (1.0) Calculated Property
Vc	0.498	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor 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	[286.74; 381.65]	J/mol×K	[456.32; 661.61]
Cp,gas	286.74	J/mol×K	456.32	Joback Calculated Property
Cp,gas	304.79	J/mol×K	490.53	Joback Calculated Property
Cp,gas	321.90	J/mol×K	524.75	Joback Calculated Property
Cp,gas	338.11	J/mol×K	558.96	Joback Calculated Property
Cp,gas	353.45	J/mol×K	593.18	Joback Calculated Property
Cp,gas	367.96	J/mol×K	627.39	Joback Calculated Property
Cp,gas	381.65	J/mol×K	661.61	Joback Calculated Property
η	[0.0002282; 0.0103400]	Pa×s	[212.36; 456.32]
η	0.0103400	Pa×s	212.36	Joback Calculated Property
η	0.0032862	Pa×s	253.02	Joback Calculated Property
η	0.0014345	Pa×s	293.68	Joback Calculated Property
η	0.0007661	Pa×s	334.34	Joback Calculated Property
η	0.0004688	Pa×s	375.00	Joback Calculated Property
η	0.0003157	Pa×s	415.66	Joback Calculated Property
η	0.0002282	Pa×s	456.32	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexene,1-(2-methylpropyl)-.

Sources

• Cheméo Relay (1.0)
• 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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