2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596)

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ChEBI Name	2-(1-phenylethyl)-1,3-dioxolane

ChEBI ID	CHEBI:87596

Definition	A dioxolane that is 1,3-dioxolane substituted by a 1-phenylethyl group at position 2.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C11H14O2

Net Charge

Average Mass

178.22770

Monoisotopic Mass

178.09938

InChI

InChI=1S/C11H14O2/c1-9(11-12-7-8-13-11)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3

InChIKey

SATZAQAJSHXNSJ-UHFFFAOYSA-N

SMILES

CC(C1OCCO1)c1ccccc1

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology
Outgoing	2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596) has parent hydride 1,3-dioxolane (CHEBI:87597) 2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596) has role metabolite (CHEBI:25212) 2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596) is a benzenes (CHEBI:22712) 2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596) is a cyclic acetal (CHEBI:59770) 2-(1-phenylethyl)-1,3-dioxolane (CHEBI:87596) is a dioxolane (CHEBI:39430)

IUPAC Name

2-(1-phenylethyl)-1,3-dioxolane

Synonym	Source
2-phenylpropanal ethylene acetal	ChEBI

Last Modified

20 August 2015