Chemical Properties of 1,2,3,6-tetrahydromethyl-3,6-methanophthalic anhydride (CAS 25134-21-8)

InChI

InChI=1S/C10H12O3/c1-4-5-2-3-6(4)8-7(5)9(11)13-10(8)12/h4-8H,2-3H2,1H3

InChI Key

OCCLSAYXEPHUMI-UHFFFAOYSA-N

Formula

C10H12O3

SMILES

CC1C2CCC1C1C(=O)OC(=O)C21

Molecular Weight¹

180.20

CAS

25134-21-8

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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

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	[353.61; 436.86]	J/mol×K	[561.05; 779.08]
Cp,gas	353.61	J/mol×K	561.05	Joback Calculated Property
Cp,gas	369.95	J/mol×K	597.39	Joback Calculated Property
Cp,gas	385.22	J/mol×K	633.73	Joback Calculated Property
Cp,gas	399.48	J/mol×K	670.06	Joback Calculated Property
Cp,gas	412.80	J/mol×K	706.40	Joback Calculated Property
Cp,gas	425.24	J/mol×K	742.74	Joback Calculated Property
Cp,gas	436.86	J/mol×K	779.08	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2,3,6-tetrahydromethyl-3,6-methanophthalic anhydride.

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

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