2-tert-butylhydroquinone
fo-48e132fa9cc4f8e5
Identity
- Type
- Neutral molecule
- CAS
- 1948-33-0
- EC
- 217-752-2
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
32- 1,4-Benzenediol, 2-(1,1-dimethylethyl)-
- 2-(1,1-Dimethylethyl)-1,4-benzenediol
- 2-(1,1-Dimethylethyl)hydroquinone
- 2-(tert-Butyl)-p-hydroquinone
- 2-t-Butyl-1,4-benzenediol
- 2-t-Butylhydroquinone
- 2-tert-Butyl(1,4)hydroquinone
- 2-tert-Butyl-1,4-benzenediol
- 2-tert-Butyl-1,4-dihydroxybenzene
- 2-tert-Butyl-1,4-hydroquinone
- 2-tert-Butyl-4-hydroxyphenol
- 2-tert-butylbenzene-1,4-diol
- 2-Tertiary-butylhydroquinone
- Banox 20BA
- Hydroquinone, tert-butyl-
- Keniox 20
- MC-TB 20
- Mono-tert-butylhydroquinone
- Mono-tertiarybutylhydroquinone
- MTBHQ
- Stearer TBH
- t-Butyl hydroquinone
- t-Butylhydroquinone
- TBHQ
- Tenox 20
- Tenox TBHQ
- tert-Butyl-1,4-benzenediol
- tert-Butyl-1,4-dihydroxybenzene
- tert-Butyldihydroxybenzene
- tert-Butylhydroquinone
- tertiary-Butylhydroquinone
- Yantq TBHQ
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | BGNXCDMCOKJUMV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C10H14O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,11-12H,1-3H3 |
| IUPAC name chemrof:IUPAC_name | 2-tert-butylhydroquinone |
| Molecular formula chemrof:molecular_formula | C10H14O2 |
| Molecular mass chemrof:molecular_mass | 166.22 |
| Monoisotopic mass chemrof:monoisotopic_mass | 166.09938 |
| SMILES string chemrof:smiles_string | CC(C)(C)c1cc(O)ccc1O |
Known URLs
19Where 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=1948-33-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:78886 | enrich_references.chebi_id_link |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID6020220 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB07726 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4972 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL242080 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/C12674942B | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0032062 | enrich_references.chebi_xrefs |
| hts.usitc.gov | https://hts.usitc.gov/search?query=2907.29.25.00 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.135K | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-36677 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=45244 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C77508 | enrich_references.pubchem_identifier_url |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL242080 | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/16043 | enrich_references.pubchem_compound |
| reaxys | reaxys:637923 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/1362739 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q662443 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Tert-Butylhydroquinone | enrich_references.chebi_xrefs |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 57c96a60-c3a3-4ee9-84c3-eeeb264a2c99 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 8a30f652-9f37-4a6a-b8b6-3bd711f7629f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| d35a0c9b-03d9-4b9b-9945-187c91b9b647 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| da56a96a-18ba-479b-bcdb-9d04ae615e40 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| e9b427ce-8fcf-4056-8087-9b2161150618 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 20284b69-b6a5-4168-af22-b77035b11e42 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 200d7dc4-be7e-42d5-b3a5-f6cae8cf60d7 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| db315d44-06f2-45fa-a425-975b6fcd8c77 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 0a36f27e-fbd8-43f3-ae90-28b4a83cbec9 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 458830af-5aef-4c28-9a43-a115dd1e4344 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9d4735aa-b7a8-4335-95d6-b0fb36aafcf3 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 6ba1d792-fd04-4764-9126-8a98215e6b32 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 92256719-6f48-4e58-99c7-566bdeac68a4 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
{
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{
"@value": "Mono-tert-butylhydroquinone",
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{
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{
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{
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{
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},
{
"@value": "tert-Butyldihydroxybenzene",
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{
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{
"@value": "tertiary-Butylhydroquinone",
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{
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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