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CHEBI:141558 - 2,4-dimethylheptane

ChEBI IDCHEBI:141558
ChEBI Name2,4-dimethylheptane
Stars
DefinitionAn alkane that is heptane in which a hydrogen has been replaced by a methyl group at positions 2 and 4.
Last Modified11 August 2018
Submittermwilliams
DownloadsMolfile
FormulaC9H20
Net Charge0
Average Mass128.259
Monoisotopic Mass128.15650
SMILESCCCC(C)CC(C)C
InChIInChI=1S/C9H20/c1-5-6-9(4)7-8(2)3/h8-9H,5-7H2,1-4H3
InChIKeyAUKVIBNBLXQNIZ-UHFFFAOYSA-N
Roles Classification
Biological Role:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
ChEBI Ontology
Outgoing Relation(s)
2,4-dimethylheptane (CHEBI:141558) has role fungal metabolite (CHEBI:76946)
2,4-dimethylheptane (CHEBI:141558) is a alkane (CHEBI:18310)
2,4-dimethylheptane (CHEBI:141558) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
2,4-dimethylheptane
Registry NumbersSources
CAS:2213-23-2ChemIDplus
CAS:2213-23-2NIST Chemistry WebBook
Citations