Chemical Properties of Prezizaan-15-al

InChI

InChI=1S/C15H24O/c1-10-4-5-13-14(2,3)12(9-16)11-6-7-15(10,13)8-11/h9-13H,4-8H2,1-3H3/t10-,11+,12?,13?,15-/m1/s1

InChI Key

FHSLAXWYMZHYPS-BRUFSJIZSA-N

Formula

C15H24O

SMILES

CC1CCC2C(C)(C)C(C=O)C3CCC12C3

Molecular Weight¹

220.35

• 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.
• I : 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°	99.84	kJ/mol	Joback Calculated Property
ΔfH°gas	-262.97	kJ/mol	Joback Calculated Property
ΔfusH°	17.72	kJ/mol	Joback Calculated Property
ΔvapH°	52.56	kJ/mol	Joback Calculated Property
log10WS	-3.62		Crippen Calculated Property
logPoct/wat	3.674		Crippen Calculated Property
McVol	191.200	ml/mol	McGowan Calculated Property
Pc	2157.31	kPa	Joback Calculated Property
Inp	[1660.00; 1683.00]
Inp	1661.00		NIST
Inp	1683.00		NIST
Inp	1663.00		NIST
Inp	1660.00		NIST
Inp	1661.00		NIST
I	[2155.00; 2155.00]
I	2155.00		NIST
I	2155.00		NIST
Tboil	606.49	K	Joback Calculated Property
Tc	831.12	K	Joback Calculated Property
Tfus	382.67	K	Joback Calculated Property
Vc	0.741	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[553.11; 672.85]	J/mol×K	[606.49; 831.12]
Cp,gas	553.11	J/mol×K	606.49	Joback Calculated Property
Cp,gas	575.51	J/mol×K	643.93	Joback Calculated Property
Cp,gas	596.54	J/mol×K	681.37	Joback Calculated Property
Cp,gas	616.51	J/mol×K	718.81	Joback Calculated Property
Cp,gas	635.69	J/mol×K	756.25	Joback Calculated Property
Cp,gas	654.37	J/mol×K	793.69	Joback Calculated Property
Cp,gas	672.85	J/mol×K	831.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to Prezizaan-15-al.

Sources

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

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