Chemical Properties of Bicyclo[2.4.0]octan-2-one, 3,3-dimethyl-5-oxa- (CAS 7176-96-7)

InChI

InChI=1S/C9H14O2/c1-9(2)7(10)6-4-3-5-11-8(6)9/h6,8H,3-5H2,1-2H3

InChI Key

KLTAJTHKXFNMDQ-UHFFFAOYSA-N

Formula

C9H14O2

SMILES

CC1(C)C(=O)C2CCCOC21

Molecular Weight¹

154.21

CAS

7176-96-7

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[309.65; 401.38]	J/mol×K	[517.68; 751.35]
Cp,gas	309.65	J/mol×K	517.68	Joback Calculated Property
Cp,gas	327.47	J/mol×K	556.62	Joback Calculated Property
Cp,gas	344.09	J/mol×K	595.57	Joback Calculated Property
Cp,gas	359.66	J/mol×K	634.51	Joback Calculated Property
Cp,gas	374.31	J/mol×K	673.46	Joback Calculated Property
Cp,gas	388.17	J/mol×K	712.40	Joback Calculated Property
Cp,gas	401.38	J/mol×K	751.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.4.0]octan-2-one, 3,3-dimethyl-5-oxa-.

Sources

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

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