2,4,6-tri-tert-butylphenol

2,4,6-Tri-t-butylphenol
2,4,6-Tri-tert-butyl-1-hydroxybenzene
2,4,6-Tris(1,1-dimethylethyl)phenol
2,4,6-Tris(tert-butyl)phenol
2,4,6-Tritert-butylphenol
264F
Alkofen B
Antioxidant Q 46
Phenol, 2,4,6-tri-tert-butyl-
Phenol, 2,4,6-tris(1,1-dimethylethyl)-
Tri-tert-butylphenol
Voidox

Property	Value
InChI2D key string chemrof:inchi2d_key_string	PFEFOYRSMXVNEL-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C18H30O/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11,19H,1-9H3
IUPAC name chemrof:IUPAC_name	2,4,6-tri-tert-butylphenol
Molecular formula chemrof:molecular_formula	C18H30O
Molecular mass chemrof:molecular_mass	262.437
Monoisotopic mass chemrof:monoisotopic_mass	262.229666
SMILES string chemrof:smiles_string	CC(C)(C)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

Where 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=732-26-3	enrich_references.consensus_cas_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.010.900	enrich_references.pubchem_identifier_url
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID2021311	enrich_references.pubchem_identifier_url
dtp.cancer.gov	https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=14459	enrich_references.pubchem_identifier_url
ebi.ac.uk	https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL387905	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/99J2VIC675	enrich_references.pubchem_identifier_url
HMDB	https://hmdb.ca/metabolites/HMDB0245480	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J151.222F	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/12902	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q27272216	enrich_references.pubchem_identifier_url
Wikipedia	https://en.wikipedia.org/wiki/2,4,6-Tri-tert-butylphenol	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
5686f230-1f6c-49fc-93be-e571c8b1263e	Environmental → Air → Aircraft cruise height	EF 3.1	kg	4
d4e40613-55ab-4457-91cf-d0c651cec720	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	4
45947d89-c42c-4c67-bdac-b5f676a30344	Environmental → Air → Indoor	EF 3.1	kg	4
350e0f46-c9ed-4d08-b263-8a8ceb1a581c	Environmental → Air → Long-term	EF 3.1	kg	0
e3d72066-29d9-49bf-b58a-5874b8996de8	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	4
49a371a3-18a2-4bcd-980c-9a1267f3dc14	Environmental → Air → Unknown	EF 3.1	kg	4
7ca1f676-98d1-4e60-8828-69b49fd515ca	Environmental → Ground → Agricultural	EF 3.1	kg	4
9b976ca9-94f0-45f7-ac20-c9d0e069756d	Environmental → Ground → Non-agricultural	EF 3.1	kg	4
d6a5a09e-9935-48b4-aeb5-467e2c342531	Environmental → Ground → Unknown	EF 3.1	kg	4
429b1a7c-0e06-4b93-b679-010ffd77eecb	Environmental → Water → Long-term	EF 3.1	kg	0
cf341309-85b3-46ec-a0fe-cff095cb7035	Environmental → Water → Ocean	EF 3.1	kg	4
930e8b47-6854-48d4-b578-caf887ed5ad6	Environmental → Water → Surface water	EF 3.1	kg	4
a5e9f445-9216-4561-8cc1-4fa0eba14390	Environmental → Water → Unknown	EF 3.1	kg	4

Everything that changed this substance (55 changes)

Open the changes page

Flow object JSON

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    "seed_uuid": "350e0f46-c9ed-4d08-b263-8a8ceb1a581c",
    "seed_source": "EF 3.1",
    "semantic_typing": {
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      "reason": "",
      "types": [
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      ],
      "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": [
        "732-26-3"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=732-26-3"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=732-26-3"
        }
      ],
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "211-989-5"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=211-989-5"
      ],
      "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": [
    "https://w3id.org/chemrof/NeutralMolecule"
  ]
}

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

2,4,6-tri-tert-butylphenol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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