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Methyl Acetate

2D structure
UUID e2fb04d6-6555-11dd-ad8b-0800200c9a66
Deprecated yes
Replaced By e2fb04d5-6555-11dd-ad8b-0800200c9a66
Flow Object IDfo-a7e523ca18082a5c
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 79-20-9
EC Numbers 201-185-2
prefLabel
Language Value Provenance
en Methyl Acetate
altLabel ⓘ
Language Value Provenance
en AcOMe
en CH3CO2CH3
en CH3COOCH3
en Devoton
en MeOAc
en Methylacetat
en Tereton
en acetate de methyle
en acetic acid methyl ester
en methyl ethanoate
en Acetic acid, methyl ester
en NSC 405071
Definitions
Language Value Provenance
en An acetate ester resulting from the formal condensation of acetic acid with methanol. A low-boiling (57 °C) colourless, flammable liquid, it is used as a solvent for many resins and oils.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey KXKVLQRXCPHEJC-UHFFFAOYSA-N
InChI InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3
IUPAC name acetic acid methyl ester, methyl acetate, methyl ethanoate
Molecular formula C3H6O2
Molecular mass 74.079
Monoisotopic mass 74.036779, 74.03678
SMILES CC(=O)OC, COC(C)=O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 e2fb04d6-6555-11dd-ad8b-0800200c9a66 methyl acetate

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=methylacetate||dimension=Environmental > media=Air > strata=Unknown; cas=79-20-9; added Common Chemistry CAS names as altLabel: Acetic acid, methyl ester, NSC 405071; object_uuid=fo-a7e523ca18082a5c
cas_match_labels 1 — consensus_match group_key=methylacetate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'79-20-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7e523ca18082a5c: {'79-20-9': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': 'AcOMe', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:AcOMe', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'CH3CO2CH3', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3CO2CH3', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'CH3COOCH3', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3COOCH3', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Devoton', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Devoton', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'MeOAc', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:MeOAc', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methylacetat', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methylacetat', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tereton', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Tereton', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'acetate de methyle', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:acetate de methyle', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'acetic acid methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:acetic acid methyl ester', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'methyl ethanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:methyl ethanoate', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'AcOMe', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:AcOMe', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'CH3CO2CH3', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3CO2CH3', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'CH3COOCH3', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:CH3COOCH3', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Devoton', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Devoton', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'MeOAc', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:MeOAc', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Methylacetat', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Methylacetat', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Tereton', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Tereton', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'acetate de methyle', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:acetate de methyle', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'acetic acid methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:acetic acid methyl ester', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'methyl ethanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:methyl ethanoate', 'http://purl.obolibrary.org/obo/CHEBI_77700', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Acetic acid, methyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:79-20-9', 'https://commonchemistry.cas.org/detail?cas_rn=79-20-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 405071', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:79-20-9', 'https://commonchemistry.cas.org/detail?cas_rn=79-20-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=methylacetate||dimension=Environmental > media=Air > strata=Unknown; cas=79-20-9; added Common Chemistry CAS names as altLabel: Acetic acid, methyl ester, NSC 405071; object_uuid=fo-a7e523ca18082a5c
cas_match_labels None {'79-20-9': 'exactMatch'} group_key=methylacetate||dimension=Environmental > media=Air > strata=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'79-20-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-a7e523ca18082a5c: {'79-20-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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