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1-bromohexane

UUID 079bfa82-e048-43e3-8f1c-d84f4ec28f9e
Flow Object IDfo-7d246562832279cc
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 111-25-1
EC Numbers 203-850-2
prefLabel
Language Value Provenance
en 1-bromohexane
altLabel
Language Value Provenance
en 1-Hexane bromide
en 1-Hexylbromide
en <em>n</em>-Hexyl bromide
en Hexane, 1-bromo-
en Hexyl bromide
en NSC 71206
References
Shared Properties
Predicate Value
InChIKey CBGDIJWINPWWJW-UHFFFAOYSA-N, MNDIARAMWBIKFW-UHFFFAOYSA-N
InChI InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,14H,1-3H3,(H,16,17), InChI=1S/C6H13Br/c1-2-3-4-5-6-7/h2-6H2,1H3
IUPAC name 1-bromanylhexane, 1-bromohexane, 3,4,5-trimethyl-6-oxidanyl-8-oxidanylidene-3,4-dihydroisochromene-7-carboxylic acid, 6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydro-2-benzopyran-7-carboxylic acid, 6-hydroxy-3,4,5-trimethyl-8-oxo-3,4-dihydroisochromene-7-carboxylic acid, 6-hydroxy-8-keto-3,4,5-trimethyl-3,4-dihydroisochromene-7-carboxylic acid
Molecular formula C13H14O5, C6H13Br
SMILES CC1C(OC=C2C1=C(C(=C(C2=O)C(=O)O)O)C)C, CCCCCCBr

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 079bfa82-e048-43e3-8f1c-d84f4ec28f9e 1-bromohexane

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1-bromohexane Emissions/Emissions to water/Emissions to water, unspecified 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=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; cas=111-25-1; added Common Chemistry CAS names as altLabel: 1-Hexane bromide, 1-Hexylbromide, <em>n</em>-Hexyl bromide, Hexane, 1-bromo-, Hexyl bromide, NSC 71206; object_uuid=fo-7d246562832279cc
cas_match_labels 1 consensus_match group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-25-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d246562832279cc: {'111-25-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1-Hexane bromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1-Hexylbromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>n</em>-Hexyl bromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexane, 1-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Hexyl bromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 71206', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-25-1', 'https://commonchemistry.cas.org/detail?cas_rn=111-25-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; cas=111-25-1; added Common Chemistry CAS names as altLabel: 1-Hexane bromide, 1-Hexylbromide, <em>n</em>-Hexyl bromide, Hexane, 1-bromo-, Hexyl bromide, NSC 71206; object_uuid=fo-7d246562832279cc
cas_match_labels None {'111-25-1': 'exactMatch'} group_key=1-bromohexane||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'111-25-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7d246562832279cc: {'111-25-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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}