Chemical Properties of Rosifoliol

InChI

InChI=1S/C15H26O/c1-11-6-5-8-15(4)9-7-12(10-13(11)15)14(2,3)16/h10-12,16H,5-9H2,1-4H3/t11-,12-,15+/m0/s1

InChI Key

SRHDLIDOZXPROB-SLEUVZQESA-N

Formula

C15H26O

SMILES

CC1CCCC2(C)CCC(C(C)(C)O)C=C12

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.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	14.76	kJ/mol	Joback Calculated Property
logPoct/wat	3.920		Crippen Calculated Property
McVol	202.060	ml/mol	McGowan Calculated Property
Inp	[1599.00; 1615.00]
Inp	1603.00		NIST
Inp	Outlier 1615.00		NIST
Inp	1602.00		NIST
Inp	1599.00		NIST
Inp	1599.00		NIST
Inp	1599.00		NIST
Inp	1599.00		NIST
I	[2133.00; 2144.00]
I	2144.00		NIST
I	Outlier 2133.00		NIST
I	2144.00		NIST
I	2144.00		NIST
I	2144.00		NIST
I	2144.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[262.69; 759.57]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-1.72870e+02
Coefficient B			2.00198e+00
Coefficient C			-1.64664e-03
Coefficient D			5.77100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	262.69	J/mol×K	273.00	Calculated Property
Cp,gas	354.85	J/mol×K	353.78	Calculated Property
Cp,gas	433.51	J/mol×K	434.56	Calculated Property
Cp,gas	500.50	J/mol×K	515.33	Calculated Property
Cp,gas	557.65	J/mol×K	596.11	Calculated Property
Cp,gas	606.77	J/mol×K	676.89	Calculated Property
Cp,gas	649.70	J/mol×K	757.67	Calculated Property
Cp,gas	688.26	J/mol×K	838.44	Calculated Property
Cp,gas	724.28	J/mol×K	919.22	Calculated Property
Cp,gas	759.57	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Rosifoliol.

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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