Chemical Properties of Karahana ether

InChI

InChI=1S/C10H16O/c1-7-4-5-9-10(2,3)8(7)6-11-9/h8-9H,1,4-6H2,2-3H3

InChI Key

FCTMDYJWWVBWKQ-UHFFFAOYSA-N

Formula

C10H16O

SMILES

C=C1CCC2OCC1C2(C)C

Molecular Weight¹

152.23

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

Physical Properties

Property	Value	Unit	Source
ΔfusH°	15.32	kJ/mol	Joback Calculated Property
ΔvapH°	55.07	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	2.378		Crippen Calculated Property
McVol	131.610	ml/mol	McGowan Calculated Property
I	[1368.00; 1370.00]
I	1368.00		NIST
I	1370.00		NIST
I	1368.00		NIST
Tboil	474.14	K	Relay (1.0) Calculated Property
Tfus	300.81	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation 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	[173.15; 499.87]	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			-1.21370e+02
Coefficient B			1.38134e+00
Coefficient C			-1.23870e-03
Coefficient D			4.78600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	173.15	J/mol×K	273.00	Calculated Property
Cp,gas	233.47	J/mol×K	353.78	Calculated Property
Cp,gas	284.26	J/mol×K	434.56	Calculated Property
Cp,gas	327.02	J/mol×K	515.33	Calculated Property
Cp,gas	363.27	J/mol×K	596.11	Calculated Property
Cp,gas	394.53	J/mol×K	676.89	Calculated Property
Cp,gas	422.30	J/mol×K	757.67	Calculated Property
Cp,gas	448.11	J/mol×K	838.44	Calculated Property
Cp,gas	473.46	J/mol×K	919.22	Calculated Property
Cp,gas	499.87	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to Karahana ether.

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.
These property values are available through the Cheméo API. A free account gives you an access key.