Bis(2-methylpropyl) Cyclohexane-1,2-dicarboxylate
fo-9f8b92e39d838275
Identity
- Type
- Neutral molecule
- CAS
- 70969-58-3
- EC
- 275-069-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
4- 1,2-Cyclohexanedicarboxylic acid, 1,2-bis(2-methylpropyl) ester
- 1,2-Cyclohexanedicarboxylic acid, bis(2-methylpropyl) ester
- Cyclohexane-1,2-dicarboxylic acid di(isobutyl) ester
- Diisobutyl 1,2-cyclohexanedicarboxylate
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | QUKHPBOCBWDYMW-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C16H28O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h11-14H,5-10H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | Bis(2-methylpropyl) Cyclohexane-1,2-dicarboxylate |
| Molecular formula chemrof:molecular_formula | C16H28O4 |
| Molecular mass chemrof:molecular_mass | 284.396 |
| Monoisotopic mass chemrof:monoisotopic_mass | 284.198759 |
| SMILES string chemrof:smiles_string | CC(C)COC(=O)C1CCCCC1C(=O)OCC(C)C |
Known URLs
6Where 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=70969-58-3 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.068.223 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID60887773 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J288.709F | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/116722 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q82867033 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| bf2faa10-40cd-4a98-81bf-9428dafa509f | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| dc775089-4eb7-42c0-b0ff-c603f685fb70 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| 248814fd-f2cf-4a3f-b2f5-caa8f6392c46 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 1f2bf3c7-50bd-46f0-8e8e-fe30d85dd2ca | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| e1c8b725-ab2e-4a9e-aa42-c4dd643e50f3 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| 5037f346-9f2b-420f-91fd-ff05e3528e1e | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 0a18b82c-aed3-4a09-b49c-b937b54c549f | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 19c7db15-85fe-4c70-8916-aae442964137 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| eae06e51-5151-4940-8abc-965a49a1cfd5 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 94edcee6-bbab-4d02-981d-4af8c55c776f | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9b517943-8d43-4d86-b9bb-915325e60499 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| e3808463-0623-41bc-8c75-497f3ef6f986 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| a3704fa9-3b7b-4406-a88b-4698eed1a9e4 | Environmental → Water → Unknown | EF 3.1 | kg | 4 |
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
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