Thiophene
fo-b1b2f3e03f44a52a
Identity
- Type
- Neutral molecule
- CAS
- 110-02-1
- EC
- 203-729-4
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
Alternative labels
11- Divinylene sulfide
- Furan, thio-
- Huile H50
- Huile HSO
- Thiacyclopentadiene
- Thiaphene
- thiofuran
- Thiofurfuran
- Thiole
- Thiophen
- Thiotetrole
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | YTPLMLYBLZKORZ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H |
| IUPAC name chemrof:IUPAC_name | Thiophene |
| Molecular formula chemrof:molecular_formula | C4H4S |
| Molecular mass chemrof:molecular_mass | 84.143 |
| Monoisotopic mass chemrof:monoisotopic_mass | 84.00337, 84.003371 |
| SMILES string chemrof:smiles_string | c1ccsc1 |
Known URLs
28Where 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=107760-19-0 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=110-02-1 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=127473-73-8 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=127473-74-9 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=127473-75-0 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=25233-34-5 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=51325-05-4 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=64059-51-4 | enrich_references.pubchem_identifier_url |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:30856 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.003.392 | enrich_references.pubchem_identifier_url |
| chemicalsafety.ilo.org | https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=1190 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID8026145 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=405073 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL278958 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:26113 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SMB37IQ40B | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0029718 | enrich_references.chebi_xrefs |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.162.593B | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.445G | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=44008 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/8030 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/erg/#2414 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=018335 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/11211052 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/15474614 | enrich_references.chebi_xrefs |
| reaxys | reaxys:103222 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q305364 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Thiophene | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 312ce2b4-f7e8-4a53-9e16-e52da9f414c5 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 0c497abe-80e1-4cff-8bac-64519896c1e6 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 267f2e16-c60b-4d06-afdd-f36a5579bd7d | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 013f3991-0846-4c8c-ba5a-c388769ca859 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 8fbed5ac-5053-4508-80f6-96f60fb9935c | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 9b781976-d386-4169-bc74-ef0043041bec | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| a918f90a-8dc6-4c1d-b59c-d1d964a53a59 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| d67194c2-2463-4a1c-9549-db46b5d52f64 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 09b82086-2898-4879-91ec-7cc96c0daefb | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| c1df512b-3643-4ea3-8bbf-425eac0cd73e | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 5a1cdb93-989c-404f-ad11-dd030f7c6d8a | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| a11e13cb-b29e-44ce-a22c-dce2d78e31d9 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 218090f1-b04d-498d-bbb5-35220470347e | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
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