Chemical Properties of 3-Oxabicyclo[3.2.1]octane-2,4-dione, 1,8,8-trimethyl-, (1S)- (CAS 595-31-3)

InChI

InChI=1S/C10H14O3/c1-9(2)6-4-5-10(9,3)8(12)13-7(6)11/h6H,4-5H2,1-3H3

InChI Key

VFZDNKRDYPTSTP-UHFFFAOYSA-N

Formula

C10H14O3

SMILES

CC12CCC(C(=O)OC1=O)C2(C)C

Molecular Weight¹

182.22

CAS

595-31-3

Other Names

• (1S)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione
• (d)-camphoric anhydride

• 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_fusH : Enthalpy of fusion at a given temperature (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	[385.35; 481.85]	J/mol×K	[608.62; 862.17]
Cp,gas	385.35	J/mol×K	608.62	Joback Calculated Property
Cp,gas	402.73	J/mol×K	650.88	Joback Calculated Property
Cp,gas	419.25	J/mol×K	693.14	Joback Calculated Property
Cp,gas	435.16	J/mol×K	735.39	Joback Calculated Property
Cp,gas	450.72	J/mol×K	777.65	Joback Calculated Property
Cp,gas	466.20	J/mol×K	819.91	Joback Calculated Property
Cp,gas	481.85	J/mol×K	862.17	Joback Calculated Property
ΔfusH	[5.65; 8.70]	kJ/mol	[493.60; 495.00]
ΔfusH	5.65	kJ/mol	493.60	NIST
ΔfusH	8.70	kJ/mol	495.00	NIST

Similar Compounds

Find more compounds similar to 3-Oxabicyclo[3.2.1]octane-2,4-dione, 1,8,8-trimethyl-, (1S)-.

Sources

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

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