CHEBI:28488 - m-xylene

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ChEBI Name m-xylene
ChEBI ID CHEBI:28488
ChEBI ASCII Name m-xylene
Definition A xylene carrying methyl groups at positions 1 and 3.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:10590, CHEBI:25100
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Formula C8H10
Net Charge 0
Average Mass 106.16500
Monoisotopic Mass 106.078
InChI InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3
InChIKey IVSZLXZYQVIEFR-UHFFFAOYSA-N
SMILES Cc1cccc(C)c1
ChEBI Ontology
Outgoing m-xylene (CHEBI:28488) is a xylene (CHEBI:27338)
Incoming 2,4,6-trinitroxylene (CHEBI:77316) has functional parent m-xylene (CHEBI:28488)
musk xylene (CHEBI:77320) has functional parent m-xylene (CHEBI:28488)
3,5-xylenol (CHEBI:38572) has parent hydride m-xylene (CHEBI:28488)
IUPAC Name
1,3-xylene
Synonyms Sources
1,3-Dimethylbenzene KEGG COMPOUND
1,3-Dimethylbenzol ChEBI
1,3-Xylene KEGG COMPOUND
3-xylene ChemIDplus
m-dimethylbenzene UM-BBD
m-methyltoluene NIST Chemistry WebBook
m-Xylene KEGG COMPOUND
m-xylene UniProt
m-Xylol UM-BBD
meta-xylene NIST Chemistry WebBook
Database Links Databases
c0240 UM-BBD
C07208 KEGG COMPOUND
HMDB0059810 HMDB
M-xylene Wikipedia
META-XYLENE MetaCyc
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Registry Numbers Types Sources
101390 Gmelin Registry Number Gmelin
108-38-3 CAS Registry Number ChemIDplus
108-38-3 CAS Registry Number NIST Chemistry WebBook
605441 Reaxys Registry Number Reaxys
605441 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
14755610 PubMed citation Europe PMC
22360283 PubMed citation Europe PMC
24389912 PubMed citation Europe PMC
Last Modified
10 January 2017
General Comment
2014-02-04 Occasionally found in the urine samples of humans exposed to such solvents.