3-bromothiophene

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UUID 761549c7-ae17-450b-b996-a6423ff88d4a

Flow Object ID fo-819f3e1cf9d32c5b

Source EF 3.1

Context Environmental → Air → Ground level → Rural (<1000 people/square mile)

CAS Numbers 872-31-1

EC Numbers 212-821-3

prefLabel

Language	Value	Provenance
`en`	`3-bromothiophene`

altLabel ⓘ

Language	Value	Provenance
`en`	`3-Bromothiofuran`
`en`	`3-Thienyl bromide`
`en`	`NSC 96612`
`en`	`Thiophene, 3-bromo-`
`en`	`β-Bromothiophene`

References

Shared Properties

Predicate	Value
InChIKey	`QBGQCRUYARHQGO-UHFFFAOYSA-N, XCMISAPCWHTVNG-UHFFFAOYSA-N`
InChI	`InChI=1S/C4H3BrS/c5-4-1-2-6-3-4/h1-3H, InChI=1S/C9H8BrFO2/c1-13-9(12)4-6-2-3-7(10)5-8(6)11/h2-3,5H,4H2,1H3`
IUPAC name	`2-(4-bromo-2-fluoro-phenyl)acetic acid methyl ester, 2-(4-bromo-2-fluorophenyl)acetic acid methyl ester, 3-bromanylthiophene, 3-bromothiophene, methyl 2-(4-bromanyl-2-fluoranyl-phenyl)ethanoate, methyl 2-(4-bromo-2-fluoro-phenyl)acetate, methyl 2-(4-bromo-2-fluorophenyl)acetate`
Molecular formula	`C4H3BrS, C9H8BrFO2`
SMILES	`C1=CSC=C1Br, COC(=O)CC1=C(C=C(C=C1)Br)F`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`761549c7-ae17-450b-b996-a6423ff88d4a`	3-bromothiophene

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	3-bromothiophene	Emissions/Emissions to air/Emissions to air, unspecified (long-term)	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=3-bromothiophene\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=872-31-1; added Common Chemistry CAS names as altLabel: 3-Bromothiofuran, 3-Thienyl bromide, NSC 96612, Thiophene, 3-bromo-, β-Bromothiophene; object_uuid=fo-819f3e1cf9d32c5b
`cas_match_labels`	1	`—`	consensus_match	group_key=3-bromothiophene\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'872-31-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-819f3e1cf9d32c5b: {'872-31-1': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
strata	Ground level
population_density	Rural (<1000 people/square mile)

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '3-Bromothiofuran', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:872-31-1', 'https://commonchemistry.cas.org/detail?cas_rn=872-31-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Thienyl bromide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:872-31-1', 'https://commonchemistry.cas.org/detail?cas_rn=872-31-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 96612', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:872-31-1', 'https://commonchemistry.cas.org/detail?cas_rn=872-31-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thiophene, 3-bromo-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:872-31-1', 'https://commonchemistry.cas.org/detail?cas_rn=872-31-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'β-Bromothiophene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:872-31-1', 'https://commonchemistry.cas.org/detail?cas_rn=872-31-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=3-bromothiophene\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=872-31-1; added Common Chemistry CAS names as altLabel: 3-Bromothiofuran, 3-Thienyl bromide, NSC 96612, Thiophene, 3-bromo-, β-Bromothiophene; object_uuid=fo-819f3e1cf9d32c5b
`cas_match_labels`	`None`	`{'872-31-1': 'exactMatch'}`	group_key=3-bromothiophene\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'872-31-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-819f3e1cf9d32c5b: {'872-31-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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