2(3H)-Oxazolone, 3,4,5-triphenyl- supplier

Name
3,4,5-triphenyl-1,3-oxazol-2(3H)-one
EINECS
CAS No. 6652-42-2
Article Data7
CAS DataBase
Density 1.257 g/cm³
Solubility
Melting Point
Formula C₂₁H₁₅NO₂
Boiling Point 466.5 °C at 760 mmHg
Molecular Weight 313.356
Flash Point 235.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Oxazolin-2-one,3,4,5-triphenyl- (6CI,7CI,8CI);3,4,5-Triphenyl-4-oxazolin-2-one;NSC 76692;
PSA
LogP

2(3H)-Oxazolone, 3,4,5-triphenyl- Specification

The 2(3H)-Oxazolone, 3,4,5-triphenyl-, with the CAS registry number 6652-42-2, has the molecular formula C₂₁H₁₅NO₂. Besides, its molecular weight is 313.3493. Its systematic name is called 3,4,5-triphenyl-1,3-oxazol-2(3H)-one.

Physical properties of 2(3H)-Oxazolone, 3,4,5-triphenyl-: (1)ACD/LogP: 5.11; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#Freely Rotating Bonds: 3; (5)Index of Refraction: 1.66; (6)Molar Refractivity: 92.06 cm³; (7)Molar Volume: 249.1 cm³; (8)Surface Tension: 53.5 dyne/cm; (9)Density: 1.257 g/cm³; (10)Flash Point: 235.9 °C; (11)Enthalpy of Vaporization: 72.83 kJ/mol; (12)Boiling Point: 466.5 °C at 760 mmHg; (13)Vapour Pressure: 7.06E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2O\C(=C(/N2c1ccccc1)c3ccccc3)c4ccccc4
(2)InChI: InChI=1/C21H15NO2/c23-21-22(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)20(24-21)17-12-6-2-7-13-17/h1-15H
(3)InChIKey: OOIRRIVSRGZVHH-UHFFFAOYAR

Product Name

3,4,5-triphenyl-1,3-oxazol-2(3H)-one

2(3H)-Oxazolone, 3,4,5-triphenyl- Specification

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