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CHEBI:77513 - 5-phenylundecane
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ChEBI Ontology
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ChEBI Name
5-phenylundecane
ChEBI ID
CHEBI:77513
Definition
An alkylbenzene comprising undecane substituted at position 5 by a phenyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Jen Hammock
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Formula
C17H28
Net Charge
0
Average Mass
232.40420
Monoisotopic Mass
232.21910
InChI
InChI=1S/C17H28/c1-3-5-7-9-13-16(12-6-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3
InChIKey
RRPCXIBGXYGQNC-UHFFFAOYSA-N
SMILES
CCCCCCC(CCCC)c1ccccc1
ChEBI Ontology
Outgoing
5-phenylundecane (
CHEBI:77513
)
is a
alkylbenzene (
CHEBI:38976
)
IUPAC Name
undecan-5-ylbenzene
Synonyms
Sources
(1-butylheptyl)benzene
ChEBI
α-butylheptylbenzene
ChEBI
Registry Numbers
Types
Sources
4388912
Reaxys Registry Number
Reaxys
4537-15-9
CAS Registry Number
NIST Chemistry WebBook
4537-15-9
CAS Registry Number
ChemIDplus
Last Modified
12 March 2014