Chemical Properties of Epicedrol

InChI

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

InChI Key

SVURIXNDRWRAFU-UHFFFAOYSA-N

Formula

C15H26O

SMILES

CC1CCC2C(C)(C)C3CC12CCC3(C)O

Molecular Weight¹

222.37

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	13.22	kJ/mol	Joback Calculated Property
logPoct/wat	3.610		Crippen Calculated Property
McVol	195.500	ml/mol	McGowan Calculated Property
Inp	[1593.00; 1632.00]
Inp	1611.00		NIST
Inp	1626.00		NIST
Inp	1615.00		NIST
Inp	1608.00		NIST
Inp	1616.00		NIST
Inp	1611.00		NIST
Inp	1611.00		NIST
Inp	1611.00		NIST
Inp	1613.00		NIST
Inp	1619.00		NIST
Inp	1619.00		NIST
Inp	1626.00		NIST
Inp	Outlier 1593.00		NIST
Inp	1632.00		NIST
Inp	1600.00		NIST
Inp	1607.00		NIST
Inp	1631.30		NIST
Inp	1607.00		NIST
Inp	1631.30		NIST
Inp	1619.00		NIST
I	[2147.00; 2162.00]
I	2147.00		NIST
I	2162.00		NIST
I	2162.00		NIST
I	2147.00		NIST
Tfus	370.19	K	Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[595.87; 710.99]	J/mol×K	[650.45; 863.93]
Cp,gas	595.87	J/mol×K	650.45	Joback Calculated Property
Cp,gas	615.86	J/mol×K	686.03	Joback Calculated Property
Cp,gas	635.09	J/mol×K	721.61	Joback Calculated Property
Cp,gas	653.89	J/mol×K	757.19	Joback Calculated Property
Cp,gas	672.58	J/mol×K	792.77	Joback Calculated Property
Cp,gas	691.51	J/mol×K	828.35	Joback Calculated Property
Cp,gas	710.99	J/mol×K	863.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to Epicedrol.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
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