CAS No.115011-73-9,3-Trityl-5-oxazolidinone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	115011-73-9
Name:	3-Trityl-5-oxazolidinone
Article Data:	1

Formula:	C₂₂H₁₉NO₂
Molecular Weight:	329.398
Synonyms:	3-Triphenylmethyl-5-oxazolidinone;3-Trityl-5-oxazolidinone;N-Triphenylmethyl-5-oxazolidinone;
Density:	1.208 g/cm³
Melting Point:	153-155 °C(Solv: benzene (71-43-2); hexane (110-54-3))
Boiling Point:	476.7 °C at 760 mmHg
Flash Point:	161.7 °C
PSA:	29.54000
LogP:	3.73270

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Specification

The 5-Oxazolidinone,3-(triphenylmethyl)-, with the CAS registry number 115011-73-9, is also known as N-Triphenylmethyl-5-oxazolidinone. This chemical's molecular formula is C₂₂H₁₉NO₂ and molecular weight is 329.39. What's more, its systematic name is 3-trityl-1,3-oxazolidin-5-one.

Physical properties of 5-Oxazolidinone,3-(triphenylmethyl)- are: (1)ACD/LogP: 3.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.44; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 240.6; (6)ACD/BCF (pH 7.4): 240.61; (7)ACD/KOC (pH 5.5): 1762.49; (8)ACD/KOC (pH 7.4): 1762.61; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.627; (14)Molar Refractivity: 96.67 cm³; (15)Molar Volume: 272.6 cm³; (16)Polarizability: 38.32×10^-24cm³; (17)Surface Tension: 51.4 dyne/cm; (18)Density: 1.208 g/cm³; (19)Flash Point: 161.7 °C; (20)Enthalpy of Vaporization: 74.04 kJ/mol; (21)Boiling Point: 476.7 °C at 760 mmHg; (22)Vapour Pressure: 2.99E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C4OCN(C(c1ccccc1)(c2ccccc2)c3ccccc3)C4
(2)InChI: InChI=1S/C22H19NO2/c24-21-16-23(17-25-21)22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2
(3)InChIKey: MLOBYZUIPXPCOL-UHFFFAOYSA-N