O-hydroxybenzoyl ferrocene
Basic information
- CAS
1295-36-9- Standard SMILES
O=C(c1ccc[cH-]1)c1ccccc1O.[Fe+2].c1cc[cH-]c1- InChIKey
XTGSSUUMDPVFSA-UHFFFAOYSA-N- Molecular formula
- C17H14FeO2
- Average molar mass
- 306.14 g/mol
- Monoisotopic mass
- 306.034315
Names & identifiers
- Preferred name
- O-hydroxybenzoyl ferrocene
- IUPAC
- cyclopenta-1,3-diene;cyclopenta-1,3-dien-1-yl-(2-hydroxyphenyl)methanone;iron(2+)
Names & synonyms
O-hydroxybenzoyl ferrocene
Database identifiers
- CAS
1295-36-9- PubChem CID
- 517129
Properties
Computed structural properties
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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