(4-Hydroxyphenyl)ferrocene
Basic information
- CAS
32994-52-8- Standard SMILES
Oc1ccc(-[c-]2cccc2)cc1.[Fe+2].c1cc[cH-]c1- InChIKey
PBKSAWGZZXKEBJ-UHFFFAOYSA-N- Molecular formula
- C16H14FeO
- Average molar mass
- 278.13 g/mol
- Monoisotopic mass
- 278.039401
Names & identifiers
- Preferred name
- (4-Hydroxyphenyl)ferrocene
- IUPAC
- cyclopenta-1,3-diene;4-cyclopenta-2,4-dien-1-ylphenol;iron(2+)
Names & synonyms
4-FerrocenylphenylAskin(4-Hydroxyphenyl)ferroceneFerrocene, (4-hydroxyphenyl)-Iron, cyclopentadienyl((p-hydroxyphenyl)cyclopentadienyl)-RefChem:208836DTXCID90109117DTXSID50186626Iron, cyclopentadienyl((p-hydroxyphenyl)cyclopentadienyl)-(7CI)
Database identifiers
- CAS
32994-52-8- PubChem CID
- 208772
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 142
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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