F15

PENTADECANOIC ACID

Created: 2004-11-16
Last modified:  2024-09-27

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Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count46
Aromatic Bond Count0
2D diagram of F15

Chemical Component Summary

NamePENTADECANOIC ACID
Systematic Name (OpenEye OEToolkits)pentadecanoic acid
FormulaC15 H30 O2
Molecular Weight242.397
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(O)CCCCCCCCCCCCCC
SMILESCACTVS3.341CCCCCCCCCCCCCCC(O)=O
SMILESOpenEye OEToolkits1.5.0CCCCCCCCCCCCCCC(=O)O
Canonical SMILESCACTVS3.341 CCCCCCCCCCCCCCC(O)=O
Canonical SMILESOpenEye OEToolkits1.5.0 CCCCCCCCCCCCCCC(=O)O
InChIInChI1.03 InChI=1S/C15H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17/h2-14H2,1H3,(H,16,17)
InChIKeyInChI1.03 WQEPLUUGTLDZJY-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 13849
ChEMBL CHEMBL460025
ChEBI CHEBI:42504
CCDC/CSD ZZZDDP02, ZZZDDP01, ZZZDDP05
COD 7050155