EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:30674 - ferrocenecarboxylic acid
| Formula | C11H10FeO2 |
| Net Charge | 0 |
| Average Mass | 230.044 |
| Monoisotopic Mass | 230.00302 |
| SMILES | O=C(O)[C]12[CH]3[CH]4[CH]5[CH]1[Fe]45321678[CH]2[CH]1[CH]6[CH]7[CH]28 |
| InChI | InChI=1S/C6H5O2.C5H5.Fe/c7-6(8)5-3-1-2-4-5;1-2-4-5-3-1;/h1-4H,(H,7,8);1-5H; |
| InChIKey | VUJLGCHOGQEAED-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| ferrocenecarboxylic acid (CHEBI:30674) has parent hydride ferrocene (CHEBI:30672) |
| ferrocenecarboxylic acid (CHEBI:30674) is a ferrocenes (CHEBI:51005) |
| IUPAC Name |
|---|
| ferrocenecarboxylic acid |
| Synonyms | Source |
|---|---|
| carboxyferrocene | IUPAC |
| ferrocene carboxylic acid | NIST Chemistry WebBook |