Ferrocene
fo-a8e2f3fdaf6b136b
Identity
- Type
- Neutral molecule
- CAS
- 102-54-5
- EC
- 203-039-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
25- [Fe(eta(5)-C5H5)2]
- [FeCp2]
- bis(cyclopentadienyl)iron
- bis(eta(5)-2,4-cyclopentadien-1-yl)iron
- bis(eta(5)-cyclopentadienyl)iron
- bis(eta(5)-cyclopentadienyl)iron(II)
- Bis(η-cyclopentadienyl)iron
- Bis(η5-cyclopentadienyl)iron
- biscyclopentadienyliron
- Catane TM
- di(pi-cyclopentadienyl)iron
- di-2,4-cyclopentadien-1-yliron
- Di-π-cyclopentadienyl iron
- dicyclopentadienyl iron
- Dicyclopentadienyleisen
- Dicyclopentadienyliron
- Ferrocen
- Ferrotsen
- iron bis(cyclopentadiene)
- iron bis(cyclopentadienide)
- iron dicyclopentadienyl
- Iron(2+) Dicyclopenta-2,4-dienide
- Iron, bis(η5-2,4-cyclopentadien-1-yl)-
- PLUTOcen F-C
- PLUTOcen G
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | DFRHTHSZMBROSH-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/2C5H5.Fe/c2*1-2-4-5-3-1;/h2*1-5H; |
| Molecular formula chemrof:molecular_formula | C10H10Fe |
| Molecular mass chemrof:molecular_mass | 186.035 |
| Monoisotopic mass chemrof:monoisotopic_mass | 186.013188, 186.01319 |
| SMILES string chemrof:smiles_string | [CH]12[CH]3[CH]4[CH]5[CH]1[Fe]23451678[CH]2[CH]1[CH]6[CH]7[CH]28 |
Known URLs
10Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=102-54-5 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:30672 | enrich_references.chebi_id_link |
| gmelin | gmelin:3385 | enrich_references.chebi_xrefs |
| molbase | molbase:740 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17455192 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21270987 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21338333 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21428900 | enrich_references.chebi_xrefs |
| reaxys | reaxys:6609436 | enrich_references.chebi_xrefs |
| Wikipedia | https://en.wikipedia.org/wiki/Ferrocene | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 3691d0a2-7766-4578-9bbd-5a1e5c8b0a58 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 16097649-e104-4a88-a902-1825f3fd3af3 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 51d70d7b-d900-49db-bea3-3ad094d1f3b5 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 8d275a94-af8a-4eb2-95e8-292e30f11456 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| bfcd49ed-daee-454d-81d7-5201bf7b2ae7 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 08422fd5-3b92-4041-be2c-89d83b38eb19 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| b5fc98a6-5040-4f78-a761-903cdf4b2c18 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 7d278ed8-872a-4d59-9ccc-e318291f3b8c | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 9ccae726-dc60-4690-ad3e-061fdd0452c6 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 3d4aa9a5-df79-44ff-8743-b39700e057d5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 10f46042-5d98-4640-a64d-1cc5acc2a5c7 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 0826a723-507a-428d-a13b-3f762e6f682f | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 8721e8a2-f0b0-4018-adcd-aa39dbc70775 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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}Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works