Chemical Properties of Cyclocopacamphan-12-al

InChI

InChI=1S/C15H22O/c1-8(7-16)9-4-5-14(2)10-6-11-13(12(9)10)15(11,14)3/h7-13H,4-6H2,1-3H3/t8?,9-,10+,11?,12?,13?,14?,15-/m0/s1

InChI Key

JLHUXFWGEBRDST-ZGWIHEAISA-N

Formula

C15H22O

SMILES

CC(C=O)C1CCC2(C)C3CC4C(C13)C42C

Molecular Weight¹

218.33

• 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°	206.55	kJ/mol	Joback Calculated Property
ΔfH°gas	-170.81	kJ/mol	Joback Calculated Property
ΔfusH°	20.73	kJ/mol	Joback Calculated Property
ΔvapH°	51.39	kJ/mol	Joback Calculated Property
log10WS	-3.03		Crippen Calculated Property
logPoct/wat	3.140		Crippen Calculated Property
McVol	180.340	ml/mol	McGowan Calculated Property
Pc	2235.52	kPa	Joback Calculated Property
Inp	[1562.00; 1562.00]
Inp	1562.00		NIST
Inp	1562.00		NIST
Inp	1562.00		NIST
Tboil	595.71	K	Joback Calculated Property
Tc	810.79	K	Joback Calculated Property
Tfus	399.69	K	Joback Calculated Property
Vc	0.724	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[532.24; 637.19]	J/mol×K	[595.71; 810.79]
Cp,gas	532.24	J/mol×K	595.71	Joback Calculated Property
Cp,gas	551.99	J/mol×K	631.56	Joback Calculated Property
Cp,gas	570.42	J/mol×K	667.40	Joback Calculated Property
Cp,gas	587.84	J/mol×K	703.25	Joback Calculated Property
Cp,gas	604.57	J/mol×K	739.10	Joback Calculated Property
Cp,gas	620.91	J/mol×K	774.95	Joback Calculated Property
Cp,gas	637.19	J/mol×K	810.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Cyclocopacamphan-12-al.

Sources

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

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