(2z)-1,1,1,4,4,4-hexafluorobut-2-ene
fo-2977eb02144b1118
Identity
- Type
- NeutralMolecule
- CAS
- 692-49-9
- EC
- 700-651-7
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 78 across every transformer
Structure
This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.
Alternative labels
22- (2Z)-1,1,1,4,4,4-Hexafluoro-2-butene
- (Z)-HFO 1336
- (Z)-HFO 1336mzz
- 1336mzzZ
- 2-Butene, 1,1,1,4,4,4-hexafluoro-, (2Z)-
- 2-Butene, 1,1,1,4,4,4-hexafluoro-, (Z)-
- cis-1,1,1,4,4,4-Hexafluoro-2-butene
- Formacel FEA 1100
- HCFO-1336mzz(Z)
- HFC 1336mzz
- HFO 1336mzz-Z
- HFO 1336mzzm(z)
- HFO-1336mzz(Z)
- HFO-Z 1336mzz
- Opteon SF 33
- R 1336mzz(Z)
- Z 1336mzz
- Z-1,1,1,4,4,4-Hexafluoro-2-butene
- Z-F 11E
- Z-FC 1336mzz
- Z-HFO 1336mzz
- (Z)-HFC-1336
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | NLOLSXYRJFEOTA-UPHRSURJSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C4H2F6/c5-3(6,7)1-2-4(8,9)10/h1-2H/b2-1- |
| Isomeric SMILES string chemrof:isomeric_smiles_string | FC(F)(F)/C=C\C(F)(F)F |
| IUPAC name chemrof:IUPAC_name | (2z)-1,1,1,4,4,4-hexafluorobut-2-ene, (2Z)-1,1,1,4,4,4-Hexafluoro-2-butene |
| Molecular formula chemrof:molecular_formula | C4H2F6 |
| Molecular mass chemrof:molecular_mass | 164.048 |
| Monoisotopic mass chemrof:monoisotopic_mass | 164.006069 |
| SMILES string chemrof:smiles_string | FC(F)(F)C=CC(F)(F)F |
Known URLs
6Where 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=692-49-9 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.217.885 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID00883476 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J143.848D | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/52991879 | enrich_references.pubchem_compound |
| wikidata.org | https://www.wikidata.org/wiki/Q22668721 | enrich_references.pubchem_identifier_url |
Elementary flows
18| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 7d11ad70-e251-11e6-bf01-fe55135034f3 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 6 |
| 7d11b09a-e251-11e6-bf01-fe55135034f3 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 6 |
| 92a28a5a-3e98-4a5c-adaf-05902bd90eaf | Environmental → Air → Indoor | EF 3.1 | kg | 6 |
| 2dc60ddf-2d1a-49f5-9fb2-07318fa56770 | Environmental → Air → Long-term | EF 3.1 | kg | 2 |
| 7d11af14-e251-11e6-bf01-fe55135034f3 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 6 |
| 7d11aa00-e251-11e6-bf01-fe55135034f3 | Environmental → Air → Unknown | EF 3.1 | kg | 6 |
| ee346409-b925-4246-9785-f61f0b5851f9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 94586003-7f63-406b-853f-a1ad7cb12315 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 8fb5fda9-faaa-4725-a93d-68577170e175 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 94e704ea-cb0f-4206-a17c-8e923debe862 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| cb54d2b4-8c4a-4735-a079-5bd87acf2b70 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| fed51d3e-e575-4d1f-a262-cdcc63833b6c | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| dfc7ca9e-8cc0-468f-89bd-9dd79f5b4a81 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
| c8d43081-501f-406d-87d9-91833597dae3 deprecated | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 6 |
| 85eda009-b27e-4f70-8c3c-3e37a67ce2f2 deprecated | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 6 |
| 7d11abcc-e251-11e6-bf01-fe55135034f3 deprecated | Environmental → Air → Long-term | EF 3.1 | kg | 2 |
| cef99574-b208-4b18-af3e-b3793e71b9bd deprecated | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 6 |
| f456ee11-cd52-4513-a8f1-30310eb23e32 deprecated | Environmental → Air → Unknown | EF 3.1 | kg | 6 |
History
Everything that changed this substance (78 changes)
Full record
Flow object JSON
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