Chemical Properties of «alpha»-Phenylglutaric anhydride (CAS 2959-96-8)

InChI

InChI=1S/C11H10O3/c12-10-7-6-9(11(13)14-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2

InChI Key

NVPRNSAYSSEIGR-UHFFFAOYSA-N

Formula

C11H10O3

SMILES

O=C1CCC(c2ccccc2)C(=O)O1

Molecular Weight¹

190.20

CAS

2959-96-8

Other Names

• 2-phenylglutaric anhydride
• 2H-Pyran-2,6(3H)-dione, dihydro-3-phenyl-

• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate 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	[355.20; 431.30]	J/mol×K	[615.01; 859.72]
Cp,gas	355.20	J/mol×K	615.01	Joback Calculated Property
Cp,gas	370.76	J/mol×K	655.79	Joback Calculated Property
Cp,gas	385.15	J/mol×K	696.58	Joback Calculated Property
Cp,gas	398.38	J/mol×K	737.36	Joback Calculated Property
Cp,gas	410.47	J/mol×K	778.15	Joback Calculated Property
Cp,gas	421.44	J/mol×K	818.93	Joback Calculated Property
Cp,gas	431.30	J/mol×K	859.72	Joback Calculated Property

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[491.20; 497.20]	K	[1.70; 1.70]
Tboilr	491.20	K	1.70	NIST
Tboilr	497.20	K	1.70	NIST

Similar Compounds

Find more compounds similar to «alpha»-Phenylglutaric 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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