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CHEBI:167603 - trans-1,4-dimethylcyclohexane

ChEBI IDCHEBI:167603
ChEBI Nametrans-1,4-dimethylcyclohexane
Stars
ASCII Nametrans-1,4-dimethylcyclohexane
DefinitionThe trans-isomer of 1,4-dimethylcyclohexane.
Last Modified5 March 2021
SubmitterAdnan
DownloadsMolfile
FormulaC8H16
Net Charge0
Average Mass112.216
Monoisotopic Mass112.12520
SMILESC[C@H]1CC[C@H](C)CC1
InChIInChI=1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3/t7-,8-
InChIKeyQRMPKOFEUHIBNM-ZKCHVHJHSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
trans-1,4-dimethylcyclohexane (CHEBI:167603) is a 1,4-dimethylcyclohexane (CHEBI:165732)
IUPAC Name 
trans-1,4-dimethylcyclohexane
Synonyms  Source
(1r,4r)-1,4-dimethylcyclohexaneIUPAC
trans-hexahydro-p-xyleneChEBI
trans-p-hexahydroxyleneChEBI
1,trans-4-dimethylcyclohexaneNIST Chemistry WebBook
1,4(trans)-dimethylcyclohexaneNIST Chemistry WebBook
Registry NumbersSources
Reaxys:1900344Reaxys
CAS:2207-04-7NIST Chemistry WebBook
CAS:2207-04-7ChemIDplus
Citations