Chemical Properties of 9-Methyltricyclo[4.2.1.1(2,5)]deca-3,7-diene-9,10-diol (CAS 78323-73-6)

InChI

InChI=1S/C11H14O2/c1-11(13)8-4-5-9(11)7-3-2-6(8)10(7)12/h2-10,12-13H,1H3

InChI Key

OLANDCXXFRSOLN-UHFFFAOYSA-N

Formula

C11H14O2

SMILES

CC1(O)C2C=CC1C1C=CC2C1O

Molecular Weight¹

178.23

CAS

78323-73-6

• 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°	-30.45	kJ/mol	Joback Calculated Property
ΔfH°gas	-292.81	kJ/mol	Joback Calculated Property
ΔfusH°	24.09	kJ/mol	Joback Calculated Property
ΔvapH°	71.86	kJ/mol	Joback Calculated Property
log10WS	-1.60		Crippen Calculated Property
logPoct/wat	0.716		Crippen Calculated Property
McVol	136.410	ml/mol	McGowan Calculated Property
Pc	3642.13	kPa	Joback Calculated Property
Inp	[1299.00; 1299.00]
Inp	1299.00		NIST
Inp	1299.00		NIST
Tboil	644.48	K	Joback Calculated Property
Tc	839.79	K	Joback Calculated Property
Tfus	398.37	K	Joback Calculated Property
Vc	0.519	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[408.81; 476.18]	J/mol×K	[644.48; 839.79]
Cp,gas	408.81	J/mol×K	644.48	Joback Calculated Property
Cp,gas	421.26	J/mol×K	677.03	Joback Calculated Property
Cp,gas	433.05	J/mol×K	709.58	Joback Calculated Property
Cp,gas	444.31	J/mol×K	742.13	Joback Calculated Property
Cp,gas	455.16	J/mol×K	774.68	Joback Calculated Property
Cp,gas	465.74	J/mol×K	807.24	Joback Calculated Property
Cp,gas	476.18	J/mol×K	839.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to 9-Methyltricyclo[4.2.1.1(2,5)]deca-3,7-diene-9,10-diol.

Sources

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

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