1-ethynylcyclohexanol
fo-a0ff4ceb23b9d072
Identity
- Type
- Neutral molecule
- CAS
- 78-27-3
- EC
- 201-100-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
9- (1-Hydroxycyclohexyl)acetylene
- (1-Hydroxycyclohexyl)ethyne
- 1-Ethynyl-1-cyclohexanol
- 1-Ethynyl-1-hydroxycyclohexane
- 1-Ethynylcyclohexanal
- 1-Hydroxy-1-ethynylcyclohexane
- Bluesil RTRD-PA 40
- Cyclohexanol, 1-ethynyl-
- Ethynylcyclohexanol
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | QYLFHLNFIHBCPR-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H12O/c1-2-8(9)6-4-3-5-7-8/h1,9H,3-7H2 |
| IUPAC name chemrof:IUPAC_name | 1-ethynylcyclohexanol |
| Molecular formula chemrof:molecular_formula | C8H12O |
| Molecular mass chemrof:molecular_mass | 124.183 |
| Monoisotopic mass chemrof:monoisotopic_mass | 124.088815 |
| SMILES string chemrof:smiles_string | C#CC1(O)CCCCC1 |
Known URLs
12Where 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=28652-54-2 | enrich_references.pubchem_identifier_url |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=78-27-3 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.001.001 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.044.643 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0021757 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=8194 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL394631 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/6RV04025EH | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J55.435I | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/6525 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27265398 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/1-Ethynylcyclohexanol | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 22e4b01e-0bd6-4589-abc2-5b5046a680f4 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| 5d7d1b4c-325a-44f5-8bfd-fe999a133ab2 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| b257e065-e1e2-4546-ab60-bc88b7c9d812 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 34ee40f5-8a35-430c-8e7c-f5d5647c866c | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 625c4b48-d1dc-442f-a6cb-21bcd523dc22 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 4d98708c-4374-4c70-9402-f3bdf546223a | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 675d425b-7bf5-4d41-8993-f4f5309adee7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| fe9a45ec-d696-4d5f-ace2-1ec089160c31 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 14ac0104-65c6-46d1-a166-ff6201d0b941 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 7a6f42ad-d2f5-41ef-901b-9381bd77e244 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| d5321535-0bdf-4539-b979-cf41ce1c2d3f | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 1e591828-5a35-4356-9734-c9a62945a3bb | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 47d3425b-98ae-4206-8c17-a458558c9744 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
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