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Dibromoacetic Acid

UUID 7141bd25-8cec-4593-b39b-91c636501c0e
Flow Object IDfo-96bb1622bfd4038d
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 631-64-1
EC Numbers 211-165-5
prefLabel
Language Value Provenance
en Dibromoacetic Acid
altLabel ⓘ
Language Value Provenance
en 2,2-Dibromoacetic acid
en 2,2-dibromoethanoic acid
en DBAA
en Dibromoethanoic acid
en Acetic acid, 2,2-dibromo-
en Acetic acid, dibromo-
Definitions
Language Value Provenance
en A monocarboxylic acid that is acetic acid in which two of the methyl hydrogens are replaced by bromo groups.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey SIEILFNCEFEENQ-UHFFFAOYSA-N
InChI InChI=1S/C2H2Br2O2/c3-1(4)2(5)6/h1H,(H,5,6)
IUPAC name 2,2-bis(bromanyl)ethanoic acid, 2,2-dibromoacetic acid
Molecular formula C2H2Br2O2
Molecular mass 217.844
Monoisotopic mass 215.84215
SMILES C(C(=O)O)(Br)Br, O=C(O)C(Br)Br

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 7141bd25-8cec-4593-b39b-91c636501c0e dibromoacetic acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 dibromoacetic acid Emissions/Emissions to water/Emissions to fresh water kg exactMatch —

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=dibromoaceticacid||dimension=Environmental > media=Water > water_body=Ocean; cas=631-64-1; added Common Chemistry CAS names as altLabel: Acetic acid, 2,2-dibromo-, Acetic acid, dibromo-; object_uuid=fo-96bb1622bfd4038d
cas_match_labels 1 — consensus_match group_key=dibromoaceticacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'631-64-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-96bb1622bfd4038d: {'631-64-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '2,2-Dibromoacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,2-Dibromoacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,2-dibromoethanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,2-dibromoethanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'DBAA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:DBAA', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dibromoethanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dibromoethanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '2,2-Dibromoacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,2-Dibromoacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2,2-dibromoethanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2,2-dibromoethanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'DBAA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:DBAA', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Dibromoethanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Dibromoethanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_90124', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Acetic acid, 2,2-dibromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:631-64-1', 'https://commonchemistry.cas.org/detail?cas_rn=631-64-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acetic acid, dibromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:631-64-1', 'https://commonchemistry.cas.org/detail?cas_rn=631-64-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=dibromoaceticacid||dimension=Environmental > media=Water > water_body=Ocean; cas=631-64-1; added Common Chemistry CAS names as altLabel: Acetic acid, 2,2-dibromo-, Acetic acid, dibromo-; object_uuid=fo-96bb1622bfd4038d
cas_match_labels None {'631-64-1': 'exactMatch'} group_key=dibromoaceticacid||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'631-64-1': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-96bb1622bfd4038d: {'631-64-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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