FP6

pyrrolidine-1-carbaldehyde

Created: 2011-03-22
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count16
Chiral Atom Count0
Bond Count16
Aromatic Bond Count0
2D diagram of FP6

Chemical Component Summary

Namepyrrolidine-1-carbaldehyde
Systematic Name (OpenEye OEToolkits)pyrrolidine-1-carbaldehyde
FormulaC5 H9 N O
Molecular Weight99.131
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=CN1CCCC1
SMILESCACTVS3.370O=CN1CCCC1
SMILESOpenEye OEToolkits1.7.0C1CCN(C1)C=O
Canonical SMILESCACTVS3.370 O=CN1CCCC1
Canonical SMILESOpenEye OEToolkits1.7.0 C1CCN(C1)C=O
InChIInChI1.03 InChI=1S/C5H9NO/c7-5-6-3-1-2-4-6/h5H,1-4H2
InChIKeyInChI1.03 AGRIQBHIKABLPJ-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 77372