Chemical Properties of 2,3,3-Trimethyl-1-hexene

InChI

InChI=1S/C9H18/c1-6-7-9(4,5)8(2)3/h2,6-7H2,1,3-5H3

InChI Key

FJJUXGUOHOVYPK-UHFFFAOYSA-N

Formula

C9H18

SMILES

C=C(C)C(C)(C)CCC

Molecular Weight¹

126.24

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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.
• 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°	107.03	kJ/mol	Joback Calculated Property
ΔfH°gas	-122.20	kJ/mol	Joback Calculated Property
ΔfusH°	9.06	kJ/mol	Joback Calculated Property
ΔvapH°	33.74	kJ/mol	Joback Calculated Property
log10WS	-3.20		Crippen Calculated Property
logPoct/wat	3.389		Crippen Calculated Property
McVol	133.370	ml/mol	McGowan Calculated Property
Pc	2460.47	kPa	Joback Calculated Property
Inp	[824.00; 825.00]
Inp	825.00		NIST
Inp	824.00		NIST
Tboil	398.65	K	Joback Calculated Property
Tc	579.25	K	Joback Calculated Property
Tfus	177.89	K	Joback Calculated Property
Vc	0.510	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[258.60; 340.24]	J/mol×K	[398.65; 579.25]
Cp,gas	258.60	J/mol×K	398.65	Joback Calculated Property
Cp,gas	274.01	J/mol×K	428.75	Joback Calculated Property
Cp,gas	288.67	J/mol×K	458.85	Joback Calculated Property
Cp,gas	302.59	J/mol×K	488.95	Joback Calculated Property
Cp,gas	315.80	J/mol×K	519.05	Joback Calculated Property
Cp,gas	328.34	J/mol×K	549.15	Joback Calculated Property
Cp,gas	340.24	J/mol×K	579.25	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,3,3-Trimethyl-1-hexene.

Sources

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

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