2-(1-(2-hydroxy-3,5-di-tert-pentyl-phenyl)ethyl)-4,6-di-tert-pentylphenyl Acrylate/n
fo-feb2bd5f9242ce4d
Identity
- Type
- Neutral molecule
- CAS
- 123968-25-2
- EC
- 413-850-6
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
13- 1′-Hydroxy[2,2′-ethylidenebis[4,6-bis(1,1-dimethylpropyl)benzene]]-1-yl acrylate
- 2,2′-Ethylidenebis(4,6-di-tert-amylphenol) monoacrylate
- 2,4-Di-tert-amyl-6-[1-(3,5-di-tert-amyl-2-hydroxyphenyl)ethyl]phenyl acrylate
- 2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-di-tert-pentylphenyl acrylate
- 2-[1-(2-Hydroxy-3,5-di-tert-pentylphenyl)ethyl]-4,6-tert-pentylphenyl acrylate
- 2-[1-[3,5-Bis(1,1-dimethylpropyl)-2-hydroxyphenyl]ethyl]-4,6-bis(1,1-dimethylpropyl)phenyl 2-propenoate
- 2-Propenoic acid, 2-[1-[3,5-bis(1,1-dimethylpropyl)-2-hydroxyphenyl]ethyl]-4,6-bis(1,1-dimethylpropyl)phenyl ester
- Antioxidant GS
- MileOx 549GS
- Sumilizer GS
- Sumilizer GS(F)
- Sumiriser GS
- Zikanox 549DF
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | STLLXWLDRUVCHL-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C37H56O3/c1-15-31(38)40-33-28(21-26(35(9,10)17-3)23-30(33)37(13,14)19-5)24(6)27-20-25(34(7,8)16-2)22-29(32(27)39)36(11,12)18-4/h15,20-24,39H,1,16-19H2,2-14H3 |
| IUPAC name chemrof:IUPAC_name | 2,2′-Ethylidenebis(4,6-di-tert-amylphenol) monoacrylate |
| Molecular formula chemrof:molecular_formula | C37H56O3 |
| Molecular mass chemrof:molecular_mass | 548.852 |
| Monoisotopic mass chemrof:monoisotopic_mass | 548.422946 |
| SMILES string chemrof:smiles_string | C=CC(=O)Oc1c(C(C)c2cc(C(C)(C)CC)cc(C(C)(C)CC)c2O)cc(C(C)(C)CC)cc1C(C)(C)CC |
Known URLs
7Where 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=123968-25-2 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.101.303 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID7051630 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/2BBL73FIEU | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J354.981J | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/10907737 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27254521 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 34fabe64-90f7-47bc-af11-5a5edac6d1fa | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 4 |
| a0923120-36de-4235-a781-88566a9fb94a | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 4 |
| a1903c7b-6123-47e2-aa3a-d36694a78758 | Environmental → Air → Indoor | EF 3.1 | kg | 4 |
| eb638fd2-c301-4a51-91df-e2513ca8b145 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 4673237c-26a3-4589-9791-38bef26461f5 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 4 |
| c27ca544-213b-4fb4-a03c-0bfd279c01e9 | Environmental → Air → Unknown | EF 3.1 | kg | 4 |
| f35f819a-15ba-4a4d-93a1-dc1520b1b300 | Environmental → Ground → Agricultural | EF 3.1 | kg | 4 |
| 61ed2f30-e367-4aac-919d-820eacc336ac | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 4 |
| 15bf8cd4-cefc-471c-ad52-63e25d6bdcba | Environmental → Ground → Unknown | EF 3.1 | kg | 4 |
| 67623d99-a48e-40d0-b75e-3d2c145332a3 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| cc1da82b-c7cb-4bae-9476-edf7cd620195 | Environmental → Water → Ocean | EF 3.1 | kg | 4 |
| 769b5b9b-d032-40fa-b41b-fa83e8c14fe8 | Environmental → Water → Surface water | EF 3.1 | kg | 4 |
| 9d7344cf-69f0-4d71-a9df-5865a6c0d10e | 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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"CID:10907737;CAS:123968-25-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[123968-25-2]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "15bf8cd4-cefc-471c-ad52-63e25d6bdcba",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "neutral_molecule",
"reason": "",
"types": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"123968-25-2"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=123968-25-2"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=123968-25-2"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"413-850-6"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=413-850-6"
],
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
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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