4-tert-butylbenzyl Alcohol

(4-tert-butylphenyl)methanol
1-(1,1-Dimethylethyl)-4-(hydroxymethyl)benzene
4-(1,1-Dimethylethyl)benzenemethanol
4-(1,1-Dimethylethyl)benzyl alcohol
4-t-Butylbenzyl alcohol
4-tert-Butylphenylmethanol
Benzenemethanol, 4-(1,1-dimethylethyl)-
Benzyl alcohol, p-tert-butyl-
p-tert-Butylbenzyl alcohol

Property	Value
Elemental charge chemrof:elemental_charge	0
InChI2D key string chemrof:inchi2d_key_string	FVEINXLJOJPHLH-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string	InChI=1S/C11H16O/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7,12H,8H2,1-3H3
IUPAC name chemrof:IUPAC_name	4-tert-butylbenzyl Alcohol
Molecular formula chemrof:molecular_formula	C11H16O
Molecular mass chemrof:molecular_mass	164.248
Monoisotopic mass chemrof:monoisotopic_mass	164.120115, 164.12012
SMILES string chemrof:smiles_string	CC(C)(C)c1ccc(CO)cc1

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=877-65-6	enrich_references.chebi_xrefs
ChEBI	https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:167335	enrich_references.chebi_id_link
chem.echa.europa.eu	https://chem.echa.europa.eu/100.011.722	enrich_references.pubchem_identifier_url
ChemSpider	https://www.chemspider.com/Chemical-Structure.12842.html	enrich_references.chebi_xrefs
comptox.epa.gov	https://comptox.epa.gov/dashboard/DTXSID5061249	enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov	https://gsrs.ncats.nih.gov/ginas/app/beta/substances/T4Q3YX9P4N	enrich_references.pubchem_identifier_url
jglobal.jst.go.jp	http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J149.821E	enrich_references.pubchem_identifier_url
PubChem	https://pubchem.ncbi.nlm.nih.gov/compound/13416	enrich_references.pubchem_compound
Wikidata	https://www.wikidata.org/wiki/Q43686037	enrich_references.pubchem_identifier_url

Flow	Context	Source	Unit	CFs
ba180c1d-0372-4cfb-8227-9956175c9e81	Environmental → Air → Aircraft cruise height	EF 3.1	kg	2
47e3abc0-9a1e-4de3-8282-8eb7db36c203	Environmental → Air → Ground level → Urban (>1000 people/square mile)	EF 3.1	kg	2
c703669e-6b98-4795-a1e7-e3cc3d9342a4	Environmental → Air → Indoor	EF 3.1	kg	2
3032a94a-04f0-413b-ac96-196095d34b49	Environmental → Air → Long-term	EF 3.1	kg	0
635bbc93-f8d3-4b32-a4b2-acfae5cba5e8	Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile)	EF 3.1	kg	2
99cec04b-7fa3-43a7-9697-9c6156a65927	Environmental → Air → Unknown	EF 3.1	kg	2
44f3e3c4-8e15-4af6-8838-16ddae5ca88a	Environmental → Ground → Agricultural	EF 3.1	kg	2
b7c53a51-18dc-4472-b6c3-4ad9cd168fcc	Environmental → Ground → Non-agricultural	EF 3.1	kg	2
4c745e20-a4c2-434a-8c97-3aff0686e0b9	Environmental → Ground → Unknown	EF 3.1	kg	2
37ba9c9e-830f-4be7-a36c-19fa62fcc083	Environmental → Water → Long-term	EF 3.1	kg	0
2b5eee23-677c-4580-8876-6a22173cdb22	Environmental → Water → Ocean	EF 3.1	kg	2
abe0e0f8-8c5f-4f7b-af8d-e82236b68e4e	Environmental → Water → Surface water	EF 3.1	kg	2
15784873-098b-44a1-9710-da1641f5fba4	Environmental → Water → Unknown	EF 3.1	kg	2

Everything that changed this substance (57 changes)

Open the changes page

Flow object JSON

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      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=212-894-1"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "brightway-flows",
        "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

4-tert-butylbenzyl Alcohol

Identity

Structure

Alternative labels

Properties

Known URLs

Elementary flows

History

Full record

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