Chemical Properties of Junenol (CAS 472-07-1)

InChI

InChI=1S/C15H26O/c1-10(2)12-7-9-15(4)8-5-6-11(3)13(15)14(12)16/h10,12-14,16H,3,5-9H2,1-2,4H3

InChI Key

MSJJKJCIFIGTJY-UHFFFAOYSA-N

Formula

C15H26O

SMILES

C=C1CCCC2(C)CCC(C(C)C)C(O)C12

Molecular Weight¹

222.37

CAS

472-07-1

• 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.
• 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
ω	0.4780		Relay (1.0) Calculated Property
ΔfG°	41.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-340.75	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	17.73	kJ/mol	Joback Calculated Property
ΔvapH°	84.96	kJ/mol	Relay (1.0) Calculated Property
IE	8.93	eV	Relay (1.0) Calculated Property
log10WS	-4.13		Relay (1.0) Calculated Property
logPoct/wat	3.776		Crippen Calculated Property
McVol	202.060	ml/mol	McGowan Calculated Property
Pc	2066.12	kPa	Joback Calculated Property
Inp	[1588.00; 1629.00]
Inp	1618.00		NIST
Inp	Outlier 1588.00		NIST
Inp	1627.50		NIST
Inp	1629.00		NIST
Inp	1616.00		NIST
Inp	1606.00		NIST
Inp	1605.00		NIST
Inp	1603.00		NIST
Inp	1625.00		NIST
Inp	1610.00		NIST
Inp	1618.00		NIST
Inp	1627.50		NIST
I	[2028.00; 2052.00]
I	2028.00		NIST
I	2052.00		NIST
I	2028.00		NIST
I	2028.00		NIST
I	2052.00		NIST
Tboil	564.91	K	Relay (1.0) Calculated Property
Tc	784.36	K	Relay (1.0) Calculated Property
Tfus	348.61	K	Relay (1.0) Calculated Property
Vc	0.679	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[596.74; 704.61]	J/mol×K	[654.96; 859.10]
Cp,gas	596.74	J/mol×K	654.96	Joback Calculated Property
Cp,gas	616.91	J/mol×K	688.98	Joback Calculated Property
Cp,gas	636.06	J/mol×K	723.01	Joback Calculated Property
Cp,gas	654.29	J/mol×K	757.03	Joback Calculated Property
Cp,gas	671.72	J/mol×K	791.05	Joback Calculated Property
Cp,gas	688.46	J/mol×K	825.08	Joback Calculated Property
Cp,gas	704.61	J/mol×K	859.10	Joback Calculated Property

Similar Compounds

Find more compounds similar to Junenol.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.