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Environmental conditions, treatments and exposures ontology
Last uploaded:
February 14, 2023
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Preferred Name | ethyl acetate | |
Synonyms |
acetoxyethane acetic acid ethyl ester Acetyl ester acetic ester Ethylazetat vinegar naphtha ethyl acetic ester CH3-CO-O-CH3 acetic acid, ethyl ester 1-acetoxyethane Ethylacetat ethyl ethanoate Essigsaeureethylester AcOEt Essigester EtOAc Ethyl acetate ethyl acetate ETHYL ACETATE |
|
Definitions |
The acetate ester formed between acetic acid and ethanol. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_27750 |
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bearer of |
http://purl.obolibrary.org/obo/CHEBI_77706 |
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charge |
0
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|
formula |
C4H8O2
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has exact synonym |
Ethyl acetate ethyl acetate ETHYL ACETATE
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has role |
http://purl.obolibrary.org/obo/CHEBI_77706 |
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hasAlternativeId |
CHEBI:42244 CHEBI:23989 CHEBI:2389
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|
hasOBONamespace |
chebi_ontology
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hasRelatedSynonym |
acetoxyethane acetic acid ethyl ester Acetyl ester acetic ester Ethylazetat vinegar naphtha ethyl acetic ester CH3-CO-O-CH3 acetic acid, ethyl ester 1-acetoxyethane Ethylacetat ethyl ethanoate Essigsaeureethylester AcOEt Essigester EtOAc
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id |
CHEBI:27750
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|
inchi |
InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
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|
inchikey |
XEKOWRVHYACXOJ-UHFFFAOYSA-N
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inSubset | ||
label |
ethyl acetate
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|
mass |
88.10512
|
|
monoisotopicmass |
88.05243
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|
notation |
CHEBI:27750
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|
prefLabel |
ethyl acetate
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|
smiles |
CCOC(C)=O
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|
textual definition |
The acetate ester formed between acetic acid and ethanol.
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|
xRef |
Reaxys:506104 PMID:21797203 PMID:21764274 PMID:23089728 KNApSAcK:C00001308 PDBeChem:EEE PMID:23351147 CAS:141-78-6 Wikipedia:Ethyl_acetate PMID:23078109 Beilstein:506104 PMID:23108979 KEGG:D02319 KEGG:C00849 HMDB:HMDB0031217 KEGG:C01883 PMID:23614288 PMID:15497757 UM-BBD_compID:c0036 PMID:11684179 Gmelin:26306
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subClassOf |
http://purl.obolibrary.org/obo/CHEBI_134179 |
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