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iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:86558 - 4-acetoxy acetophenone
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ChEBI Ontology
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ChEBI Name
4-acetoxy acetophenone
ChEBI ID
CHEBI:86558
Definition
A methyl ketone that is acetophenone substituted by an acetoxy group at position 4.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C10H10O3
Net Charge
0
Average Mass
178.18460
Monoisotopic Mass
178.06299
InChI
InChI=1S/C10H10O3/c1-7(11)9-3-5-10(6-4-9)13-8(2)12/h3-6H,1-2H3
InChIKey
SMIOEQSLJNNKQF-UHFFFAOYSA-N
SMILES
CC(=O)Oc1ccc(cc1)C(C)=O
ChEBI Ontology
Outgoing
4-acetoxy acetophenone (
CHEBI:86558
)
has functional parent
acetophenone (
CHEBI:27632
)
4-acetoxy acetophenone (
CHEBI:86558
)
is a
acetophenones (
CHEBI:22187
)
4-acetoxy acetophenone (
CHEBI:86558
)
is a
phenyl acetates (
CHEBI:140310
)
IUPAC Name
4-acetylphenyl acetate
Synonyms
Sources
4-acetylphenyl acetate
ChEBI
p
-acetoxyacetophenone
ChEBI
Registry Numbers
Types
Sources
13031-43-1
CAS Registry Number
NIST Chemistry WebBook
13031-43-1
CAS Registry Number
ChemIDplus
2093080
Reaxys Registry Number
Reaxys
Last Modified
03 April 2018