3,9-bis(1,1-dimethyl-2-hydroxy Ethyl-2,4,8,10-tetraoxa Spiro[5,5] Undecane
fo-911249bb1a485e96
Identity
- Type
- Neutral molecule
- CAS
- 1455-42-1
- EC
- 485-230-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
9- 2,2′-(2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diyl)bis(2-methylpropan-1-ol)
- 2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, β,β,β′,β′-tetramethyl-
- 2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diethanol, β3,β3,β9,β9-tetramethyl-
- 2-[3-(1-Hydroxy-2-methylpropan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecan-9-yl]-2-methylpropan-1-ol
- 3,9-Bis(1,1-dimethyl-2-hydroxyethyl)-2,4,8,10-tetraoxaspiro[5.5]undecane
- 3,9-Bis(2-hydroxy-1,1-dimethylethyl)-2,4,8,10-tetraoxaspiro(5.5)undecane
- Spiroglycol
- β,β,β′β′-Tetramethyl-3,9-(2,4,8,10-tetraoxaspiro[5.5]undecane)diethanol
- β3,β3,β9,β9-Tetramethyl-2,4,8,10-tetraoxaspiro[5.5]undecane-3,9-diethanol
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | BPZIYBJCZRUDEG-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C15H28O6/c1-13(2,5-16)11-18-7-15(8-19-11)9-20-12(21-10-15)14(3,4)6-17/h11-12,16-17H,5-10H2,1-4H3 |
| IUPAC name chemrof:IUPAC_name | 2,2′-(2,4,8,10-Tetraoxaspiro[5.5]undecane-3,9-diyl)bis(2-methylpropan-1-ol) |
| Molecular formula chemrof:molecular_formula | C15H28O6 |
| Molecular mass chemrof:molecular_mass | 304.383 |
| Monoisotopic mass chemrof:monoisotopic_mass | 304.188589 |
| SMILES string chemrof:smiles_string | CC(C)(CO)C1OCC2(CO1)COC(C(C)(C)CO)OC2 |
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=1455-42-1 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.105.481 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.130.962 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.183.823 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID1075434 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J40.646E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/7569008 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q72508735 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 538ccd7f-aad7-4589-bcec-77d28df1a2d6 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| b8e3dcc5-46a0-42cd-b581-3de838a433b5 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| f4203605-13e3-4705-8178-68fcdb58b192 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| 198644d0-2b3c-4234-a36a-e03a0275348e | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| fa8be245-fe81-4b22-8a31-b07ce062fccd | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| bc638c7a-61d9-4df9-ac88-19a8f9a0cc7f | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| 4ee376f7-d42b-407c-80c9-cb78693e66c9 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| f91720dd-05cf-4ca8-ac0d-d3a539077394 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 65fcc3a6-236a-4551-9f9c-8a15f90b0778 | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| f4cf56f4-1e17-406d-bdea-d2b4a53f5472 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a1035d59-321e-4d64-995b-e114a55989e5 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 4cbf2afd-d7e3-4fe1-b181-3cc15f147ed0 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 0f88d513-2a6f-4f9b-8d8d-d460617f63db | 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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"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}
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