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Basic Information
CAS No.: 208465-72-9
Name: METHYL (2-CHLOROMETHYL)OXAZOLE-4-CARBOXYLATE
Article Data: 16
Molecular Structure:
Molecular Structure of 208465-72-9 (METHYL (2-CHLOROMETHYL)OXAZOLE-4-CARBOXYLATE)
Formula: C6H6ClNO3
Molecular Weight: 175.572
Synonyms: Methyl2-(chloromethyl)-1,3-oxazole-4-carboxylate;Methyl2-(chloromethyl)oxazole-4-carboxylate;
Density: 1.34 g/cm3
Melting Point: 74 °C
Boiling Point: 229.697 °C at 760 mmHg
Flash Point: 92.718 °C
Hazard Symbols: CorrosiveC
Risk Codes: 34
Safety: 22-26-36/37/39-45
PSA: 52.33000
LogP: 1.20000
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Chemistry

IUPAC Name: methyl 2-(chloromethyl)-1,3-oxazole-4-carboxylate 
Empirical Formula: C6H6ClNO3
Molecular Weight: 175.5697g/mol
Structure of 4-Oxazolecarboxylicacid, 2-(chloromethyl)-, methyl ester (CAS NO.208465-72-9):

Index of Refraction: 1.494
Molar Refractivity: 38.18 cm3
Molar Volume: 131 cm3
Polarizability: 15.13×10-24cm3
Surface Tension: 42.9 dyne/cm
Density: 1.339 g/cm3
Flash Point: 92.7 °C
Enthalpy of Vaporization: 46.63 kJ/mol 
Melting Point: 74 °C 
Boiling Point: 229.7 °C at 760 mmHg
Vapour Pressure: 0.0686 mmHg at 25°C 
Product Categories: pharmacetical;Building Blocks;Oxazole 
Canonical SMILES: COC(=O)C1=COC(=N1)CCl
InChI: InChI=1S/C6H6ClNO3/c1-10-6(9)4-3-11-5(2-7)8-4/h3H,2H2,1H3
InChIKey: CMUKPCIZFMTLKD-UHFFFAOYSA-N

Safety Profile

Hazard Codes: CorrosiveC
Hazard Note: Corrosive

Specification

  4-Oxazolecarboxylicacid, 2-(chloromethyl)-, methyl ester , its cas register number is 208465-72-9. It also can be called Methyl 2-(chloromethyl)-1,3-oxazole-4-carboxylate ; Methyl 2-chloromethyl-4-oxazolecarboxylate .