Chemical Properties of 3-Methyl-4-brendene

InChI

InChI=1S/C10H14/c1-10-3-2-8-4-7(6-10)5-9(8)10/h2-3,7-9H,4-6H2,1H3

InChI Key

YXLBQJSAWXSFAF-UHFFFAOYSA-N

Formula

C10H14

SMILES

CC12C=CC3CC(CC31)C2

Molecular Weight¹

134.22

• 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°	232.33	kJ/mol	Joback Calculated Property
ΔfH°gas	21.35	kJ/mol	Joback Calculated Property
ΔfusH°	12.06	kJ/mol	Joback Calculated Property
ΔvapH°	36.42	kJ/mol	Joback Calculated Property
log10WS	-2.58		Crippen Calculated Property
logPoct/wat	2.609		Crippen Calculated Property
McVol	114.880	ml/mol	McGowan Calculated Property
Pc	3302.95	kPa	Joback Calculated Property
Inp	[1095.00; 1095.00]
Inp	1095.00		NIST
Inp	1095.00		NIST
Tboil	443.15	K	Joback Calculated Property
Tc	659.95	K	Joback Calculated Property
Tfus	276.70	K	Joback Calculated Property
Vc	0.450	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[258.94; 352.02]	J/mol×K	[443.15; 659.95]
Cp,gas	258.94	J/mol×K	443.15	Joback Calculated Property
Cp,gas	278.18	J/mol×K	479.28	Joback Calculated Property
Cp,gas	295.66	J/mol×K	515.42	Joback Calculated Property
Cp,gas	311.60	J/mol×K	551.55	Joback Calculated Property
Cp,gas	326.17	J/mol×K	587.68	Joback Calculated Property
Cp,gas	339.58	J/mol×K	623.81	Joback Calculated Property
Cp,gas	352.02	J/mol×K	659.95	Joback Calculated Property

Similar Compounds

Find more compounds similar to 3-Methyl-4-brendene.

Sources

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

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