Chemical Properties of Tricyclo[4.2.0.02,5]octane, syn- (CAS 28636-10-4)

InChI

InChI=1S/C8H12/c1-2-6-5(1)7-3-4-8(6)7/h5-8H,1-4H2/t5-,6+,7-,8+

InChI Key

YTZCZYFFHKYOBJ-KVFPUHGPSA-N

Formula

C8H12

SMILES

C1CC2C1C1CCC21

Molecular Weight¹

108.18

CAS

28636-10-4

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• 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_fH°_liquid : Liquid phase 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).
• 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
ΔcH°liquid	-5056.00 ± 4.00	kJ/mol	NIST
ΔfG°	203.12	kJ/mol	Joback Calculated Property
ΔfH°gas	235.00 ± 4.20	kJ/mol	NIST
ΔfH°liquid	193.00 ± 4.00	kJ/mol	NIST
ΔfusH°	14.05	kJ/mol	Joback Calculated Property
ΔvapH°	[41.80; 42.00]	kJ/mol
ΔvapH°	41.80 ± 1.70	kJ/mol	NIST
ΔvapH°	42.00 ± 2.00	kJ/mol	NIST
ΔvapH°	42.00	kJ/mol	NIST
IE	9.18	eV	NIST
log10WS	-1.89		Crippen Calculated Property
logPoct/wat	2.052		Crippen Calculated Property
McVol	91.000	ml/mol	McGowan Calculated Property
Pc	3655.35	kPa	Joback Calculated Property
Tboil	393.72	K	Joback Calculated Property
Tc	594.92	K	Joback Calculated Property
Tfus	233.02	K	Joback Calculated Property
Vc	0.361	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[186.89; 274.16]	J/mol×K	[393.72; 594.92]
Cp,gas	186.89	J/mol×K	393.72	Joback Calculated Property
Cp,gas	204.36	J/mol×K	427.25	Joback Calculated Property
Cp,gas	220.54	J/mol×K	460.79	Joback Calculated Property
Cp,gas	235.52	J/mol×K	494.32	Joback Calculated Property
Cp,gas	249.40	J/mol×K	527.85	Joback Calculated Property
Cp,gas	262.25	J/mol×K	561.38	Joback Calculated Property
Cp,gas	274.16	J/mol×K	594.92	Joback Calculated Property
η	[0.0001567; 0.0008202]	Pa×s	[233.02; 393.72]
η	0.0001567	Pa×s	233.02	Joback Calculated Property
η	0.0002381	Pa×s	259.80	Joback Calculated Property
η	0.0003344	Pa×s	286.59	Joback Calculated Property
η	0.0004433	Pa×s	313.37	Joback Calculated Property
η	0.0005621	Pa×s	340.15	Joback Calculated Property
η	0.0006884	Pa×s	366.94	Joback Calculated Property
η	0.0008202	Pa×s	393.72	Joback Calculated Property

Similar Compounds

Find more compounds similar to Tricyclo[4.2.0.02,5]octane, syn-.

Sources

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

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