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CHEBI:191381 - 2,5-xylenol

ChEBI IDCHEBI:191381
ChEBI Name2,5-xylenol
Stars
DefinitionA member of the class of phenols that phenol substituted by methyl groups at positions 2 and 5.
Last Modified6 May 2022
Submittermwilliams
DownloadsMolfile
FormulaC8H10O
Net Charge0
Average Mass122.167
Monoisotopic Mass122.07316
SMILESCc1ccc(C)c(O)c1
InChIInChI=1S/C8H10O/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3
InChIKeyNKTOLZVEWDHZMU-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Chlaenius cordicollis (ncbitaxon:41305) - PubMed (22392083)
Pinus sibirica (ncbitaxon:62752) - PubMed (25641836)
Roles Classification
Biological Roles:
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
2,5-xylenol (CHEBI:191381) has parent hydride p-xylene (CHEBI:27417)
2,5-xylenol (CHEBI:191381) has role animal metabolite (CHEBI:75767)
2,5-xylenol (CHEBI:191381) has role volatile oil component (CHEBI:27311)
2,5-xylenol (CHEBI:191381) is a phenols (CHEBI:33853)
Incoming Relation(s)
2,5-dimethylphenyl hydrogen sulfate (CHEBI:191382) has functional parent 2,5-xylenol (CHEBI:191381)
IUPAC Name 
2,5-dimethylphenol
Synonyms  Source
1,2,5-xylenolChemIDplus
2,5-xylenolChemIDplus
1-hydroxy-2,5-dimethylbenzeneChemIDplus
1,4-dimethyl-2-hydroxybenzeneChemIDplus
2,5-DmpChemIDplus
3,6-dimethylphenolChemIDplus
Manual XrefsDatabases
HMDB0030540HMDB
CPD-16609MetaCyc
C00052609KNApSAcK
FDB002413FooDB
13839128ChemSpider
Registry NumbersSources
Reaxys:1099260Reaxys
CAS:95-87-4ChemIDplus
CAS:95-87-4NIST Chemistry WebBook
Citations