Chemical Properties of 2-Phenylbenzoxazone-4 (CAS 6629-80-7)

InChI

InChI=1S/C14H11NO2/c16-13-11-8-4-5-9-12(11)17-14(15-13)10-6-2-1-3-7-10/h1-9,14H,(H,15,16)

InChI Key

AMZRLVJMBHMIPA-UHFFFAOYSA-N

Formula

C14H11NO2

SMILES

O=C1NC(c2ccccc2)Oc2ccccc21

Molecular Weight¹

225.24

CAS

6629-80-7

• 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	[460.07; 534.67]	J/mol×K	[732.39; 1009.69]
Cp,gas	460.07	J/mol×K	732.39	Joback Calculated Property
Cp,gas	476.20	J/mol×K	778.61	Joback Calculated Property
Cp,gas	490.77	J/mol×K	824.82	Joback Calculated Property
Cp,gas	503.84	J/mol×K	871.04	Joback Calculated Property
Cp,gas	515.48	J/mol×K	917.26	Joback Calculated Property
Cp,gas	525.74	J/mol×K	963.47	Joback Calculated Property
Cp,gas	534.67	J/mol×K	1009.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2-Phenylbenzoxazone-4.

Sources

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

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