UPQ

4-(4-methylimidazol-1-yl)benzaldehyde

Created: 2021-03-04
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count11
2D diagram of UPQ

Chemical Component Summary

Name4-(4-methylimidazol-1-yl)benzaldehyde
Systematic Name (OpenEye OEToolkits)4-(4-methylimidazol-1-yl)benzaldehyde
FormulaC11 H10 N2 O
Molecular Weight186.21
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Cc1cn(cn1)c2ccc(C=O)cc2
SMILESOpenEye OEToolkits2.0.7Cc1cn(cn1)c2ccc(cc2)C=O
Canonical SMILESCACTVS3.385 Cc1cn(cn1)c2ccc(C=O)cc2
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1cn(cn1)c2ccc(cc2)C=O
InChIInChI1.03 InChI=1S/C11H10N2O/c1-9-6-13(8-12-9)11-4-2-10(7-14)3-5-11/h2-8H,1H3
InChIKeyInChI1.03 PVVBFOHONHPONZ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 15045260