2-ethylhexyl 2-hydroxypropanoate
fo-412602729b8a5e4d
Identity
- Type
- Neutral molecule
- CAS
- 6283-86-9
- EC
- 228-503-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
5- 2-Ethyl-1-hexanol lactate
- 2-Ethyl-1-hexyl 2-hydroxypropanoate
- 2-Ethylhexyl lactate
- Lactic acid, 2-ethylhexyl ester
- Propanoic acid, 2-hydroxy-, 2-ethylhexyl ester
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | FECDACOUYKFOOP-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C11H22O3/c1-4-6-7-10(5-2)8-14-11(13)9(3)12/h9-10,12H,4-8H2,1-3H3 |
| IUPAC name chemrof:IUPAC_name | 2-ethylhexyl 2-hydroxypropanoate |
| Molecular formula chemrof:molecular_formula | C11H22O3 |
| Molecular mass chemrof:molecular_mass | 202.294 |
| Monoisotopic mass chemrof:monoisotopic_mass | 202.156895 |
| SMILES string chemrof:smiles_string | CCCCC(CC)COC(=O)C(C)O |
Known URLs
8Where 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=6283-86-9 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.025.913 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4042333 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7737 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/V7GY6603OJ | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J206.843E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/93026 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27291634 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 4095be0b-fe6f-4613-8c72-55fa420d8fa1 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 3ab2f77a-e527-485a-94bf-58ba23b5d116 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| a303fe56-9edf-4d6e-a12d-de4d5abc1a81 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 28058151-7809-42c9-9414-888182d38fd7 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5cf26955-cd95-4e92-af1b-2f2f9b109e6a | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| fbee8912-8baf-4802-9736-cec99eabadd0 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 2722594a-d136-4621-bb27-f01914d3a067 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 736e6e27-234a-4cbe-a19b-faddfc0ee27b | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 8edfc513-036a-403f-9bd8-393db93eb49c | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 6e5bc55b-93af-477c-b982-96e05e5772ae | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 0301cfc7-1b9f-407a-8c23-43555cb4cd7b | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| dd4adb7a-1ef0-4e7d-8331-a6326dbf8663 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| dd4db278-244c-41a3-b50d-ee7bf81ccfcb | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (54 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
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