Terminology Service for NFDI4Health
hexane
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http://purl.obolibrary.org/obo/CHEBI_29021
An unbranched alkane containing six carbon atoms.
Term info
Label
hexane
Synonyms
- HEXANE
- Hexane
- hexane
Subsets
3_STAR
charge
0
formula
C6H14
has alternative id
CHEBI:10606, CHEBI:43148, CHEBI:24568, CHEBI:24566
has obo namespace
chebi_ontology
has related synonym
n-Hexane, CH3-[CH2]4-CH3, Hexan
id
CHEBI:29021
inchi
InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
inchikey
VLKZOEOYAKHREP-UHFFFAOYSA-N
mass
86.17536
monoisotopicmass
86.10955
smiles
CCCCCC
Term relations
Subclass of:
Related from:
has parent hydride
- hexanal
- 1-isothiocyanato-6-(methylsulfanyl)hexane
- 7-(methylthio)heptanonitrile oxide
- hexanol
- 2,5-hexanedione
- 3-methoxy-3-methylhexane
- hexane-2,5-diol
- hexane-1,6-diamine
- 2,4-dimethylhexane
- 2,3,5-trimethylhexane
- perfluorohexane
- 3-mercaptohexanol
- hexane-1,6-diol
- 5-iminohexane-1,2,3,4,6-pentol
- 1-nitrohexane
- 3-hexanone
- 1-iminohexane-2,3,4,5-tetrol