9OI

1,3-oxazol-4-ylmethanamine

Created:2021-11-19
Last modified:  2022-11-30

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Chemical Details

Formal Charge0
Atom Count13
Chiral Atom Count0
Bond Count13
Aromatic Bond Count5
2D diagram of 9OI

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Chemical Component Summary

Name1,3-oxazol-4-ylmethanamine
Systematic Name (OpenEye OEToolkits)1,3-oxazol-4-ylmethanamine
FormulaC4 H6 N2 O
Molecular Weight98.103
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385NCc1cocn1
SMILESOpenEye OEToolkits2.0.7c1c(nco1)CN
Canonical SMILESCACTVS3.385 NCc1cocn1
Canonical SMILESOpenEye OEToolkits2.0.7 c1c(nco1)CN
InChIInChI1.06 InChI=1S/C4H6N2O/c5-1-4-2-7-3-6-4/h2-3H,1,5H2
InChIKeyInChI1.06 ULZXEYFKBUPRQM-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 23055690