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160695-26-1

Basic Information
CAS No.: 160695-26-1
Name: (R)-4-PHENYL-3-PROPIONYL-2-OXAZOLIDINONE
Article Data: 12
Molecular Structure:
Molecular Structure of 160695-26-1 ((R)-4-PHENYL-3-PROPIONYL-2-OXAZOLIDINONE)
Formula: C12H13NO3
Molecular Weight: 219.24
Synonyms: 2-Oxazolidinone,3-(1-oxopropyl)-4-phenyl-, (R)-;(R)-4-Phenyl-3-propionyloxazolidin-2-one;
Density: 1.223 g/cm3
Melting Point: 83.5-84 °C(Solv: hexane (110-54-3); toluene (108-88-3))
Boiling Point: 393.1 °C at 760 mmHg
Flash Point: 191.6 °C
Hazard Symbols: IrritantXi, HarmfulXn
Risk Codes: 20/21/22-36/37/38
Safety: 26-36
PSA: 46.61000
LogP: 2.05440
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Specification

The 2-Oxazolidinone,3-(1-oxopropyl)-4-phenyl-, (4R)- is an organic compound with the formula C12H13NO3. The systematic name of this chemical is (4R)-4-Phenyl-3-propanoyl-1,3-oxazolidin-2-one. With the CAS registry number 160695-26-1, it is also named as (R)-4-Phenyl-3-propionyl-2-oxazolidinone. Besides, its molecular weight is 219.24.

Physical properties about 2-Oxazolidinone,3-(1-oxopropyl)-4-phenyl-, (4R)- are: (1)ACD/LogP: 0.63; (2)ACD/LogD (pH 5.5): 0.63; (3)ACD/LogD (pH 7.4): 0.63; (4)ACD/BCF (pH 5.5): 1.77; (5)ACD/BCF (pH 7.4): 1.77; (6)ACD/KOC (pH 5.5): 52.47; (7)ACD/KOC (pH 7.4): 52.47; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 46.61 Å2; (11)Index of Refraction: 1.553; (12)Molar Refractivity: 57.41 cm3; (13)Molar Volume: 179.2 cm3; (14)Polarizability: 22.76×10-24 cm3; (15)Surface Tension: 47 dyne/cm; (16)Density: 1.223 g/cm3; (17)Flash Point: 191.6 °C; (18)Enthalpy of Vaporization: 64.3 kJ/mol; (19)Boiling Point: 393.1 °C at 760 mmHg; (20)Vapour Pressure: 2.18E-06 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C12H13NO3/c1-2-11(14)13-10(8-16-12(13)15)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3/t10-/m0/s1
(2)InChIKey: TYZVFKRBBHHHSX-JTQLQIEIBI
(3)Std. InChI: InChI=1S/C12H13NO3/c1-2-11(14)13-10(8-16-12(13)15)9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3/t10-/m0/s1
(4)Std. InChIKey: TYZVFKRBBHHHSX-JTQLQIEISA-N