CHEBI:131383 - 2,2,4,4,6,8,8-heptamethylnonane

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ChEBI Name 2,2,4,4,6,8,8-heptamethylnonane
ChEBI ID CHEBI:131383
Definition A branched alkane that is nonane carrying seven methyl substituents at positions 2, 2, 4, 4, 6, 8 and 8.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H34
Net Charge 0
Average Mass 226.442
Monoisotopic Mass 226.26605
InChI InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3
InChIKey VCLJODPNBNEBKW-UHFFFAOYSA-N
SMILES CC(CC(CC(CC(C)(C)C)C)(C)C)(C)C
ChEBI Ontology
Outgoing 2,2,4,4,6,8,8-heptamethylnonane (CHEBI:131383) is a alkane (CHEBI:18310)
IUPAC Name
2,2,4,4,6,8,8-heptamethylnonane
Synonyms Sources
heptamethylnonane ChEBI
isocetane ChEBI
Manual Xref Database
Isocetane Wikipedia
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Registry Numbers Types Sources
1840009 Reaxys Registry Number Reaxys
4390-04-9 CAS Registry Number ChemIDplus
4390-04-9 CAS Registry Number NIST Chemistry WebBook
Last Modified
01 March 2016