4-Chloro-3,5-dimethylphenol
fo-b826b24cda602853
Identity
- Type
- Neutral molecule
- CAS
- 88-04-0
- EC
- 201-793-8
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 59 across every transformer
Structure
What it is used for
2
Roles, not types. A substance bears as many as apply — sulfluramid is an
insecticide and an acaricide — and each is a class ChEBI curates, asserted
with ChEBI’s own has role. The narrow ones publish the broad
ones alongside them, so a substance filed as a herbicide is a pesticide
here too. See agricultural
chemicals for what the axis is and which classes are published.
| Role | Definition | Evidence |
|---|---|---|
| molluscicide CHEBI:33904 | A substance used to destroy pests of the phylum Mollusca. | ChEBI |
| pesticide CHEBI:25944 | Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. | ChEBI |
Alternative labels
36- 2,6-Dimethyl-4-hydroxy-1-chlorobenzene
- 2-chloro-5-hydroxy-1,3-dimethylbenzene
- 2-chloro-5-hydroxy-m-xylene
- 2-Chloro-m-xylenol
- 3,5-dimethyl-4-chlorophenol
- 3,5-Dimethyl-p-chlorophenol
- 3,5-Xylenol, 4-chloro-
- 4-chloro-1-hydroxy-3,5-dimethylbenzene
- 4-chloro-3,5-xylenol
- 4-Chloro-5,3-dimethylphenol
- 4-chloro-m-xylenol
- Benzytol
- Camel
- Camel (pesticide)
- chloro-xylenol
- chloroxylenol
- chloroxylenolum
- cloroxilenol
- Desson
- Dettol
- Dettol (biocide)
- Ecotru
- Espadol
- Finecide C 2000
- Hokubarine E 400
- Husept Extra
- Nipacide PX
- Nipacide PX-R
- Ottasept
- Ottasept Extra
- p-chloro-3,5-xylenol
- p-chloro-m-xylenol
- parachlorometaxylenol
- parametaxylenol
- PCMX
- Phenol, 4-chloro-3,5-dimethyl-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | OSDLLIBGSJNGJE-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H9ClO/c1-5-3-7(10)4-6(2)8(5)9/h3-4,10H,1-2H3 |
| IUPAC name chemrof:IUPAC_name | 4-Chloro-3,5-dimethylphenol |
| Molecular formula chemrof:molecular_formula | C8H9ClO |
| Molecular mass chemrof:molecular_mass | 156.612 |
| Monoisotopic mass chemrof:monoisotopic_mass | 156.03419, 156.034193 |
| SMILES string chemrof:smiles_string | Cc1cc(O)cc(C)c1Cl |
Known URLs
49Where 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=88-04-0 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34393 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.001.631 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.013.924 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID0032316 | enrich_references.pubchem_identifier_url |
| drugbank.ca | https://www.drugbank.ca/drugs/DB11121 | enrich_references.pubchem_identifier_url |
| drugcentral | drugcentral:3094 | enrich_references.chebi_xrefs |
| drugcentral.org | https://drugcentral.org/drugcard/3094 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4971 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=756683 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL398440 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0F32U78V2Q | enrich_references.pubchem_identifier_url |
| HMDB | https://hmdb.ca/metabolites/HMDB0246387 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J4.285D | enrich_references.pubchem_identifier_url |
| KEGG | https://www.genome.jp/entry/C14715 | enrich_references.chebi_xrefs |
| KEGG | https://www.genome.jp/entry/D03473 | enrich_references.chebi_xrefs |
| kegg.jp | https://www.kegg.jp/entry/C14715 | enrich_references.pubchem_identifier_url |
| kegg.jp | https://www.kegg.jp/entry/D03473 | enrich_references.pubchem_identifier_url |
| lincs.smallmolecule | lincs.smallmolecule:LSM-19962 | enrich_references.chebi_xrefs |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=152456 | enrich_references.pubchem_identifier_url |
| ncithesaurus.nci.nih.gov | https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C76743 | enrich_references.pubchem_identifier_url |
| patent | patent:US2350677 | enrich_references.chebi_xrefs |
| platform.opentargets.org | https://platform.opentargets.org/drug/CHEMBL398440 | enrich_references.pubchem_identifier_url |
| ppdb | ppdb:1615 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/2723 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=159829 | enrich_references.pubchem_identifier_url |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/12927380 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/15167195 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/1608902 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/17498419 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/19818989 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/21860168 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/22865169 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27316554 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/27857768 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/28531838 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/3855184 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/6283866 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/7779444 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8066978 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8265774 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8272409 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/8906435 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/9124667 | enrich_references.chebi_xrefs |
| reaxys | reaxys:1862539 | enrich_references.chebi_xrefs |
| rxnav.nlm.nih.gov | https://rxnav.nlm.nih.gov/id/rxnorm/20877 | enrich_references.pubchem_identifier_url |
| vsdb | vsdb:1615 | enrich_references.chebi_xrefs |
| Wikidata | https://www.wikidata.org/wiki/Q426460 | enrich_references.pubchem_identifier_url |
| Wikipedia | https://en.wikipedia.org/wiki/Chloroxylenol | enrich_references.chebi_xrefs |
Elementary flows
14| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 7134bdd9-4c21-417c-bcce-29c0b1a0d5af | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 05222381-a058-4461-b891-6be2b54c2d0d | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 04d737cd-de65-44c7-a895-71bb5a40262c | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 86f8f0d2-a23b-4099-ae41-1efdea43dd04 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 56a5b048-0ab6-4b78-97ef-73af2f4909ca | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| f50879df-6060-4d74-8c9b-d37c2574696c | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| f1e50af0-57d0-493a-b1fc-4eebad465230 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 1fb56e32-adef-4d91-980a-222a90f2b9b2 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| c306f0ffdef532773099229bef4997951826b079 | Environmental → Ground → Silvicultural | ecoinvent algorithm addition | kg | 0 |
| 7b1abe54-db95-4236-88d8-387a106f7442 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| de1ac400-8350-479c-9c5e-a2cb27182a10 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| f22f56c8-9811-4a9e-9073-6f515ec748a3 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 87bf8cf2-20d5-4e5a-a46c-afb8794727b1 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 3cb415f0-1395-418f-9d5b-6551daf854ca | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (59 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-b826b24cda602853",
"prefLabel": [
{
"@value": "4-Chloro-3,5-dimethylphenol",
"@language": "en",
"@lang": "en",
"provenance": {
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],
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}
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],
"altLabel": [
{
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],
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},
{
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}
},
{
"@value": "2-chloro-5-hydroxy-m-xylene",
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},
{
"@value": "2-Chloro-m-xylenol",
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}
},
{
"@value": "3,5-dimethyl-4-chlorophenol",
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}
},
{
"@value": "3,5-Dimethyl-p-chlorophenol",
"@language": "en",
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],
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}
},
{
"@value": "3,5-Xylenol, 4-chloro-",
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},
{
"@value": "4-chloro-1-hydroxy-3,5-dimethylbenzene",
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{
"@value": "4-chloro-3,5-xylenol",
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},
{
"@value": "4-Chloro-5,3-dimethylphenol",
"@language": "en",
"@lang": "en",
"provenance": {
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],
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}
},
{
"@value": "4-chloro-m-xylenol",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Benzytol",
"@language": "en",
"@lang": "en",
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}
},
{
"@value": "Camel",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Camel (pesticide)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "chloro-xylenol",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "chloroxylenol",
"@language": "en",
"@lang": "en",
"provenance": {
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],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "chloroxylenolum",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
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"http://purl.obolibrary.org/obo/CHEBI_34393"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "cloroxilenol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
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"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_34393"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Desson",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dettol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "chebi_altlabels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1",
"http://purl.obolibrary.org/obo/CHEBI_34393"
],
"prov:wasDerivedFrom": "chebi synonym match"
}
},
{
"@value": "Dettol (biocide)",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ecotru",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Espadol",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Finecide C 2000",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Hokubarine E 400",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Husept Extra",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Nipacide PX",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Nipacide PX-R",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ottasept",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:88-04-0",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=88-04-0"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ottasept Extra",
"@language": "en",
"@lang": "en",
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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