Chemical Properties of Kessyl alcohol

InChI

InChI=1S/C15H26O2/c1-9-7-12(16)13-11(9)8-10-5-6-15(13,4)17-14(10,2)3/h9-13,16H,5-8H2,1-4H3

InChI Key

ZADVMZUKWWMSLQ-UHFFFAOYSA-N

Formula

C15H26O2

SMILES

CC1CC(O)C2C1CC1CCC2(C)OC1(C)C

Molecular Weight¹

238.37

• 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.
• 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	0.5228		Relay (1.0) Calculated Property
ΔfG°	-43.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-521.68	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.47	kJ/mol	Joback Calculated Property
ΔvapH°	91.30	kJ/mol	Relay (1.0) Calculated Property
IE	8.47	eV	Relay (1.0) Calculated Property
log10WS	-3.00		Relay (1.0) Calculated Property
logPoct/wat	2.987		Crippen Calculated Property
McVol	201.370	ml/mol	McGowan Calculated Property
Pc	2159.31	kPa	Joback Calculated Property
Inp	[1662.00; 1690.20]
Inp	1662.00		NIST
Inp	1690.20		NIST
Inp	1662.00		NIST
Tboil	573.34	K	Relay (1.0) Calculated Property
Tc	822.02	K	Relay (1.0) Calculated Property
Tfus	416.94	K	Relay (1.0) Calculated Property
Vc	0.748	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[638.59; 754.18]	J/mol×K	[676.56; 887.16]
Cp,gas	638.59	J/mol×K	676.56	Joback Calculated Property
Cp,gas	659.20	J/mol×K	711.66	Joback Calculated Property
Cp,gas	678.97	J/mol×K	746.76	Joback Calculated Property
Cp,gas	698.13	J/mol×K	781.86	Joback Calculated Property
Cp,gas	716.90	J/mol×K	816.96	Joback Calculated Property
Cp,gas	735.51	J/mol×K	852.06	Joback Calculated Property
Cp,gas	754.18	J/mol×K	887.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Kessyl alcohol.

Sources

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

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