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_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase 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).
• 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).
• 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
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
ΔfG°	23.63	kJ/mol	Joback Calculated Property
ΔfH°gas	-200.71	kJ/mol	Joback Calculated Property
ΔfH°liquid	-253.80 ± 2.20	kJ/mol	NIST
ΔfusH°	17.11	kJ/mol	Joback Calculated Property
ΔvapH°	35.38	kJ/mol	Joback Calculated Property
log10WS	-1.61		Crippen Calculated Property
logPoct/wat	1.574		Crippen Calculated Property
McVol	93.640	ml/mol	McGowan Calculated Property
Pc	3686.49	kPa	Joback Calculated Property
Tboil	399.59	K	Joback Calculated Property
Tc	602.57	K	Joback Calculated Property
Tfus	223.34	K	Joback Calculated Property
Vc	0.353	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[190.57; 272.58]	J/mol×K	[399.59; 602.57]
Cp,gas	190.57	J/mol×K	399.59	Joback Calculated Property
Cp,gas	206.46	J/mol×K	433.42	Joback Calculated Property
Cp,gas	221.40	J/mol×K	467.25	Joback Calculated Property
Cp,gas	235.44	J/mol×K	501.08	Joback Calculated Property
Cp,gas	248.61	J/mol×K	534.91	Joback Calculated Property
Cp,gas	260.98	J/mol×K	568.74	Joback Calculated Property
Cp,gas	272.58	J/mol×K	602.57	Joback Calculated Property
η	[0.0005708; 0.0007384]	Pa×s	[223.34; 399.59]
η	0.0007384	Pa×s	223.34	Joback Calculated Property
η	0.0006900	Pa×s	252.72	Joback Calculated Property
η	0.0006539	Pa×s	282.09	Joback Calculated Property
η	0.0006260	Pa×s	311.46	Joback Calculated Property
η	0.0006038	Pa×s	340.84	Joback Calculated Property
η	0.0005857	Pa×s	370.21	Joback Calculated Property
η	0.0005708	Pa×s	399.59	Joback Calculated Property

Similar Compounds

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

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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