Chemical Properties of Exo-2-methyl-7-oxabi-cyclo[2.2.1]heptane (CAS 16325-23-8)

InChI

InChI=1S/C7H12O/c1-5-4-6-2-3-7(5)8-6/h5-7H,2-4H2,1H3/t5-,6?,7?/m1/s1

InChI Key

YSPMLGNTRGMJLE-GRQBKTHUSA-N

Formula

C7H12O

SMILES

CC1CC2CCC1O2

Molecular Weight¹

112.17

CAS

16325-23-8

• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔcH°liquid	[-4215.70; -4215.70]	kJ/mol
ΔcH°liquid	-4215.70 ± 1.70	kJ/mol	NIST
ΔcH°liquid	-4215.70 ± 1.70	kJ/mol	NIST
ΔfH°liquid	-253.80 ± 2.20	kJ/mol	NIST
ΔfusH°	17.11	kJ/mol	Joback Calculated Property
logPoct/wat	1.574		Crippen Calculated Property
McVol	93.640	ml/mol	McGowan Calculated Property

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[190.66; 272.68]	J/mol×K	[399.79; 602.87]
Cp,gas	190.66	J/mol×K	399.79	Joback Calculated Property
Cp,gas	206.56	J/mol×K	433.64	Joback Calculated Property
Cp,gas	221.50	J/mol×K	467.48	Joback Calculated Property
Cp,gas	235.54	J/mol×K	501.33	Joback Calculated Property
Cp,gas	248.71	J/mol×K	535.18	Joback Calculated Property
Cp,gas	261.08	J/mol×K	569.03	Joback Calculated Property
Cp,gas	272.68	J/mol×K	602.87	Joback Calculated Property
η	[0.0005707; 0.0007384]	Pa×s	[223.34; 399.79]
η	0.0007384	Pa×s	223.34	Joback Calculated Property
η	0.0006899	Pa×s	252.75	Joback Calculated Property
η	0.0006538	Pa×s	282.16	Joback Calculated Property
η	0.0006259	Pa×s	311.56	Joback Calculated Property
η	0.0006037	Pa×s	340.97	Joback Calculated Property
η	0.0005856	Pa×s	370.38	Joback Calculated Property
η	0.0005707	Pa×s	399.79	Joback Calculated Property

Similar Compounds

Find more compounds similar to Exo-2-methyl-7-oxabi-cyclo[2.2.1]heptane.

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.
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