Chemical Properties of 1(3H)-Isobenzofuranone, 3-ethoxy- (CAS 16824-02-5)

InChI

InChI=1S/C10H10O3/c1-2-12-10-8-6-4-3-5-7(8)9(11)13-10/h3-6,10H,2H2,1H3

InChI Key

VCBNFFOSUGMASJ-UHFFFAOYSA-N

Formula

C10H10O3

SMILES

CCOC1OC(=O)c2ccccc21

Molecular Weight¹

178.18

CAS

16824-02-5

Other Names

• Phthalide, 3-ethoxy-
• 3-Ethoxyphthalide

• 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	[322.24; 394.27]	J/mol×K	[583.79; 817.83]
Cp,gas	322.24	J/mol×K	583.79	Joback Calculated Property
Cp,gas	336.32	J/mol×K	622.80	Joback Calculated Property
Cp,gas	349.55	J/mol×K	661.80	Joback Calculated Property
Cp,gas	361.95	J/mol×K	700.81	Joback Calculated Property
Cp,gas	373.53	J/mol×K	739.82	Joback Calculated Property
Cp,gas	384.30	J/mol×K	778.82	Joback Calculated Property
Cp,gas	394.27	J/mol×K	817.83	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1(3H)-Isobenzofuranone, 3-ethoxy-.

Sources

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

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