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

5-Oxazolecarboxylicacid, 2-chloro-, ethyl ester

Related Products

Hot Products

Name

5-Oxazolecarboxylicacid, 2-chloro-, ethyl ester

EINECS N/A
CAS No. 862599-47-1 Density 1.332 g/cm3
PSA 52.33000 LogP 1.50470
Solubility N/A Melting Point N/A
Formula C6H6ClNO3 Boiling Point 254.1 °C at 760 mmHg
Molecular Weight 175.572 Flash Point 107.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 862599-47-1 (Ethyl 2-chloro-1,3-oxazole-5-carboxylate) Hazard Symbols IrritantXi
Synonyms

Ethyl2-chloro-oxazole-5-carboxylate;

Article Data 3

5-Oxazolecarboxylicacid, 2-chloro-, ethyl ester Specification

The 5-Oxazolecarboxylicacid, 2-chloro-, ethyl ester, with the CAS registry number of 862599-47-1, is also known as Ethyl 2-chloro-1, 3-oxazole-5-carboxylate. It belongs to the product categories of Blocks; Carboxes; Oxazoles; Building Blocks; Oxazole. This chemical's molecular formula is C6H6ClNO3 and molecular weight is 175.56974. What's more, its systematic name is called Ethyl 2-chlorooxazole-5-carboxylate. In addition, it should be refrigerated preservation.

Physical properties about 5-Oxazolecarboxylicacid, 2-chloro-, ethyl ester are: (1)ACD/LogP: 1.69; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.69; (4)ACD/LogD (pH 7.4): 1.69; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 52.33 Å2; (9)Index of Refraction: 1.487; (10)Molar Refractivity: 37.94 cm3; (11)Molar Volume: 131.8 cm3; (12)Polarizability: 15.04×10-24 cm3; (13)Surface Tension: 42.1 dyne/cm; (14)Density: 1.332 g/cm3; (15)Flash Point: 107.5 °C; (16)Enthalpy of Vaporization: 49.15 kJ/mol; (17)Boiling Point: 254.1 °C at 760 mmHg; (18)Vapour Pressure: 0.0176 mmHg at 25°C.

Preparation: this chemical is prepared by reaction from Oxazole-5-carboxylic acid ethyl ester. The reaction needs reagent LiHMDS and Hexachloroethane. Meanwhile, it needs solvent Tetrahydrofuran. This reaction needs two steps, the reaction conditions are 1.) -42 °C, 30 minutes; 2.) 20 °C, 42 hours. The yield is about 67%.

You can still convert the following datas into molecular structure:
(1) SMILES: CCOC(=O)c1cnc(o1)Cl
(2) InChI: InChI=1/C6H6ClNO3/c1-2-10-5(9)4-3-8-6(7)11-4/h3H,2H2,1H3
(3) InChIKey: ZFLDTEIDAGWEEI-UHFFFAOYAD

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 862599-47-1