Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

5(4H)-Oxazolone,4-(1-methylethyl)-2-phenyl-

Related Products

Hot Products

Name

5(4H)-Oxazolone,4-(1-methylethyl)-2-phenyl-

EINECS N/A
CAS No. 5839-93-0 Density 1.15 g/cm3
PSA 38.66000 LogP 1.45020
Solubility N/A Melting Point 41-45 °C
Formula C12H13NO2 Boiling Point 281.9 °C at 760 mmHg
Molecular Weight 203.241 Flash Point 117.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 5839-93-0 (4-ISOPROPYL-2-PHENYL-2-OXAZOLINE-5-ONE) Hazard Symbols N/A
Synonyms

2-Oxazolin-5-one,4-isopropyl-2-phenyl- (6CI,8CI);4-Isopropyl-2-phenyl-2-oxazolin-5-one;NSC364043;Valine, N-benzoyl-, azlactone;

Article Data 37

5(4H)-Oxazolone,4-(1-methylethyl)-2-phenyl- Specification

The 5(4H)-Oxazolone, 4-(1-methylethyl)-2-phenyl-, with the CAS registry number of 5839-93-0, is also known as 4-Isopropyl-2-phenyl-1, 3-oxazol-5(4H)-one. This chemical's molecular formula is C12H13NO2 and molecular weight is 203.24. What's more, its IUPAC name is 2-Phenyl-4-propan-2-yl-4H-1, 3-oxazol-5-one.

Physical properties about 5(4H)-Oxazolone, 4-(1-methylethyl)-2-phenyl- are: (1)ACD/LogP: 2.38; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 38.66 Å2; (7)Index of Refraction: 1.571; (8)Molar Refractivity: 57.67 cm3; (9)Molar Volume: 175.4 cm3; (10)Surface Tension: 38.6 dyne/cm; (11)Density: 1.15 g/cm3; (12)Flash Point: 117.9 °C; (13)Enthalpy of Vaporization: 52.08 kJ/mol; (14)Boiling Point: 281.9 °C at 760 mmHg; (15)Vapour Pressure: 0.00346 mmHg at 25 °C.

Preparation: this chemical is prepared by N-Benzoyl-valine. This reaction needs reagents N-Methylmorpholine and Ethyl chloroformate. Meanwhile, it needs solvent CH2Cl2. The reaction time is 30 minutes with reaction temperature of 20 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce Benzoyl-isobutyryl-amine. The reaction needs reagent Potassium tert-butoxide and solvent Dimethylsulfoxide. The reaction time is 2 hours with reaction temperature of 0 °C. The yield is about 90 %.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C1O\C(=N/C1C(C)C)c2ccccc2
(2) InChI: InChI=1/C12H13NO2/c1-8(2)10-12(14)15-11(13-10)9-6-4-3-5-7-9/h3-8,10H,1-2H3
(3) InChIKey: KSSKJTXJMKNHPG-UHFFFAOYAW

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 5839-93-0