P60

5-(2-fluorophenyl)-1,3-oxazole-4-carboxylic acid

Created:2016-03-17
Last modified:  2017-03-29

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Chemical Details

Formal Charge0
Atom Count21
Chiral Atom Count0
Bond Count22
Aromatic Bond Count11
2D diagram of P60

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Chemical Component Summary

Name5-(2-fluorophenyl)-1,3-oxazole-4-carboxylic acid
Systematic Name (OpenEye OEToolkits)5-(2-fluorophenyl)-1,3-oxazole-4-carboxylic acid
FormulaC10 H6 F N O3
Molecular Weight207.158
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1cc(c(cc1)F)c2c(C(O)=O)nco2
SMILESCACTVS3.385OC(=O)c1ncoc1c2ccccc2F
SMILESOpenEye OEToolkits1.7.6c1ccc(c(c1)c2c(nco2)C(=O)O)F
Canonical SMILESCACTVS3.385 OC(=O)c1ncoc1c2ccccc2F
Canonical SMILESOpenEye OEToolkits1.7.6 c1ccc(c(c1)c2c(nco2)C(=O)O)F
InChIInChI1.03 InChI=1S/C10H6FNO3/c11-7-4-2-1-3-6(7)9-8(10(13)14)12-5-15-9/h1-5H,(H,13,14)
InChIKeyInChI1.03 COYYCXFHTJQGGF-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 22714196