Oxazole (data page)

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The complete data for Oxazole

Image:Hight_setter_449px.gifThe structure of Oxazole
General information

Chemical formula: C3H3NO 
Molar mass: 69.06 g·mol-1
Systematic name:
1,3-oxazole [1]
Synonyms:
none
Database data
SMILES: C1=COC=N1 [1]
InChI=1/C3H3NO/c1-2-5-3-4-1/h1-3H [1]
 ATC: N/A  CAS: 120-12-7  DrugBank: N/A  EINECS: 206-020-8 [1]  PubChem: 9255
Physical properties
Structure
Crystal data
Spectral data
UV-Vis
IR
NMR
MS
Phase behavior
Solid properties
Tm: -87 - -84 °C
Liquid properties
ρliquid: 1.050 g.cm-3
Tb: 69 - 70 °C
Gas properties
Hazard properties
MSDS N/A Main hazards:
- N/A
NFPA 704
Flash point
- N/A
R/S statement
R: N/A
S: N/A
RTECS number:
N/A
Chemical properties
XLogP: -0.123 [1] pI: ? pKa: ? Tautomers: ? Hydrogen bond: donor - 0 [1];   acceptor - 2 [1];
Pharmacological properties
Except where noted otherwise, data are given for materials in their standard state (at 25 °C, 100 kPa)


[edit] References

  1. a  b  c  d  e  f  g  PubChem 9255