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> Main
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.
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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
View more database links
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