2,3-dimethylbuta-1,3-diene
fo-5dbb7262dd7a1c21
Identity
- Type
- Neutral molecule
- CAS
- 513-81-5
- EC
- 208-172-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
8- 1,3-Butadiene, 2,3-dimethyl-
- 2,3-Dimethyl-1,3-butadiene
- 2,3-Dimethyl-1,3-butdiene
- 2,3-Dimethylbuta-1,2-diene
- 2,3-Dimethylbutadiene
- 2,3-Dimethylenebutane
- Biisopropenyl
- Diisopropenyl
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | SDJHPPZKZZWAKF-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H10/c1-5(2)6(3)4/h1,3H2,2,4H3 |
| IUPAC name chemrof:IUPAC_name | 2,3-dimethylbuta-1,3-diene |
| Molecular formula chemrof:molecular_formula | C6H10 |
| Molecular mass chemrof:molecular_mass | 82.146 |
| Monoisotopic mass chemrof:monoisotopic_mass | 82.07825 |
| SMILES string chemrof:smiles_string | C=C(C)C(=C)C |
Known URLs
9Where 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=25034-65-5 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=513-81-5 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.007.430 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID2022046 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8656 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/61TUU25HCO | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J6.282K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/10566 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q3597985 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 7bd3a5fc-14c2-46e0-a337-4bc4e0927b15 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 4d67a5ba-dcf0-4517-911a-a4ca2c8144da | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 0e5bedf6-c290-48c1-a5ac-9599d3196daa | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| bc88e495-6def-41a6-972b-e748de6fee5e | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 05c0ca25-9369-40d4-9eb2-a9049689464e | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| c8beb3ac-1721-4694-9d3f-81d1dab7743e | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 5a34f622-ce36-43dd-a7b7-2d8dba1fe0b9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 8db670a1-2c66-41fa-b31f-271f441834dd | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 6f8ff6fb-acb9-4961-b37c-a583c0ddf210 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 071b623f-c687-48c1-957d-990c806f8677 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 233aced0-33cd-4e48-8dd8-97dabdcfbfb0 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| e0fb464c-a517-4c42-a15d-3a595a6849a8 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| b06930ee-9dc4-4b00-b4ac-30e597d8c677 | 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