3-bromothiophene
fo-819f3e1cf9d32c5b
Identity
- Type
- Neutral molecule
- CAS
- 872-31-1
- EC
- 212-821-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
4- 3-Bromothiofuran
- 3-Thienyl bromide
- Thiophene, 3-bromo-
- β-Bromothiophene
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | XCMISAPCWHTVNG-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C4H3BrS/c5-4-1-2-6-3-4/h1-3H |
| IUPAC name chemrof:IUPAC_name | 3-bromothiophene |
| Molecular formula chemrof:molecular_formula | C4H3BrS |
| Molecular mass chemrof:molecular_mass | 163.039 |
| Monoisotopic mass chemrof:monoisotopic_mass | 161.913883 |
| SMILES string chemrof:smiles_string | Brc1ccsc1 |
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=84928-93-8 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=872-31-1 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.011.656 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2022129 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=96612 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/G818Z74YV0 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J25.465G | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/13383 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q927001 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/3-Bromothiophene | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 221f6b9e-2a62-4d98-9225-79c4c143f320 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 7b69f7a2-21e2-47c7-adf4-e209a6b0a415 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 21bcb728-b4a0-4981-97ac-af6aa466a3b5 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 761549c7-ae17-450b-b996-a6423ff88d4a | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| a31a294d-fb05-4d21-accb-5349fe17167b | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 94394a70-68bb-4079-b8d3-06074435643d | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| b63dec54-772b-4807-98b3-12427b73b994 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 95089002-ebeb-449c-865c-4a39301c61ef | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 83e1cb62-9ade-482d-b876-7cf6546fa451 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 7c4e2f28-6535-4af1-81a7-163d152cdce5 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| c0ef8b6f-053e-4095-80d0-fe07694d965b | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| ca706b75-c5c0-4352-8d3f-c2ea49d93587 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 17db8d2e-6576-4062-9c33-836e9e887d9d | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 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