Chemical Properties of Tricyclo[5.2.1.0(2.6)]deca-3,8-diene, 3,7-dimethyl

InChI

InChI=1S/C12H16/c1-8-3-4-10-11(8)9-5-6-12(10,2)7-9/h3,5-6,9-11H,4,7H2,1-2H3

InChI Key

IDPQERPHAWOLAG-UHFFFAOYSA-N

Formula

C12H16

SMILES

CC1=CCC2C1C1C=CC2(C)C1

Molecular Weight¹

160.26

• ω : Acentric Factor.
• 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).
• 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.
• 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
ω	0.2819		Relay (1.0) Calculated Property
ΔfG°	257.40	kJ/mol	Joback Calculated Property
ΔfH°gas	133.24	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	15.97	kJ/mol	Joback Calculated Property
ΔvapH°	51.92	kJ/mol	Relay (1.0) Calculated Property
IE	8.25	eV	Relay (1.0) Calculated Property
log10WS	-4.85		Relay (1.0) Calculated Property
logPoct/wat	3.165		Crippen Calculated Property
McVol	138.760	ml/mol	McGowan Calculated Property
Pc	2811.36	kPa	Joback Calculated Property
Inp	[1108.30; 1148.50]
Inp	1133.90		NIST
Inp	1124.50		NIST
Inp	1115.80		NIST
Inp	1108.30		NIST
Inp	1148.50		NIST
Inp	1136.80		NIST
Inp	1133.90		NIST
Inp	1136.80		NIST
Tboil	472.79	K	Relay (1.0) Calculated Property
Tc	701.80	K	Relay (1.0) Calculated Property
Tfus	290.79	K	Relay (1.0) Calculated Property
Vc	0.508	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[335.53; 431.80]	J/mol×K	[497.32; 719.64]
Cp,gas	335.53	J/mol×K	497.32	Joback Calculated Property
Cp,gas	354.90	J/mol×K	534.37	Joback Calculated Property
Cp,gas	372.68	J/mol×K	571.43	Joback Calculated Property
Cp,gas	389.05	J/mol×K	608.48	Joback Calculated Property
Cp,gas	404.23	J/mol×K	645.54	Joback Calculated Property
Cp,gas	418.42	J/mol×K	682.59	Joback Calculated Property
Cp,gas	431.80	J/mol×K	719.64	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[5.2.1.0(2.6)]deca-3,8-diene, 3,7-dimethyl.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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