2-bromo-4-chloropyridine

← Back to consensus flows

UUID 96a30fd1-c7d4-48ac-a5e2-10425b66fae7

Flow Object ID fo-d592fd6b6ca80362

Source EF 3.1

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

CAS Numbers 31098-20-1

EC Numbers 250-465-0

prefLabel ⓘ

Language	Value	Provenance
`en`	`2-bromo-4-chloropyridine`

altLabel ⓘ

Language	Value	Provenance
`en`	`1-Propanesulfonic acid, 3-hydroxy-, acrylate, potassium salt`
`en`	`2-Propenoic acid, 3-sulfopropyl ester, potassium salt`
`en`	`2-Propenoic acid, 3-sulfopropyl ester, potassium salt (1:1)`
`en`	`3-Sulfopropyl acrylate potassium salt`
`en`	`Acrylic acid 3-sulfopropyl ester potassium salt`
`en`	`Acrylic acid, ester with 3-hydroxy-1-propanesulfonic acid potassium salt`
`en`	`Potassium 3-(acryloyloxy)-1-propanesulfonate`
`en`	`Potassium 3-acryloyloxypropanesulfonate`
`en`	`Potassium 3-sulfopropyl acrylate`
`en`	`Ralu MER-SPA`
`en`	`SPA-K`
`en`	`Sulfopropyl acrylate potassium salt`

References

Shared Properties

Predicate	Value
InChIKey	`GBZVJCKJWKZSBW-UHFFFAOYSA-N, SURKZMFXICWLHU-UHFFFAOYSA-N, VSFOXJWBPGONDR-UHFFFAOYSA-M`
InChI	`InChI=1S/C5H3BrClN/c6-5-3-4(7)1-2-8-5/h1-3H, InChI=1S/C6H10O5S.K/c1-2-6(7)11-4-3-5-12(8,9)10;/h2H,1,3-5H2,(H,8,9,10);, InChI=1S/C6H10O5S.K/c1-2-6(7)11-4-3-5-12(8,9)10;/h2H,1,3-5H2,(H,8,9,10);/q;+1/p-1`
IUPAC name	`2-bromanyl-4-chloranyl-pyridine, 2-bromo-4-chloro-pyridine, 2-bromo-4-chloropyridine, potassium 3-(1-oxoprop-2-enoxy)-1-propanesulfonate, potassium 3-acryloyloxypropane-1-sulfonate, potassium 3-prop-2-enoyloxypropane-1-sulfonate`
Molecular formula	`C5H3BrClN, C6H10KO5S, C6H9KO5S`
SMILES	`C1=CN=C(C=C1Cl)Br, C=CC(=O)OCCCS(=O)(=O)O.[K], C=CC(=O)OCCCS(=O)(=O)[O-].[K+]`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`96a30fd1-c7d4-48ac-a5e2-10425b66fae7`	potassium 3-(acryloyloxy)propane-1-sulfonate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	potassium 3-(acryloyloxy)propane-1-sulfonate	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`	2	`—`	consensus_match	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=31098-20-1; added Common Chemistry CAS names as altLabel: 1-Propanesulfonic acid, 3-hydroxy-, acrylate, potassium salt, 2-Propenoic acid, 3-sulfopropyl ester, potassium salt, 2-Propenoic acid, 3-sulfopropyl ester, potassium salt (1:1), 3-Sulfopropyl acrylate potassium salt, Acrylic acid 3-sulfopropyl ester potassium salt, Acrylic acid, ester with 3-hydroxy-1-propanesulfonic acid potassium salt, Potassium 3-(acryloyloxy)-1-propanesulfonate, Potassium 3-acryloyloxypropanesulfonate, Potassium 3-sulfopropyl acrylate, Ralu MER-SPA, SPA-K, Sulfopropyl acrylate potassium salt; object_uuid=fo-d592fd6b6ca80362
`cas_match_labels`	1	`—`	consensus_match	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'31098-20-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d592fd6b6ca80362: {'31098-20-1': 'exactMatch'}
`prefLabel`	1	`—`	consensus_match	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=31098-20-1; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=3.9682; pubchem_entropy=3.6897; current_score=4.3482; pubchem_score=3.8997; score_improvement=0.4485; threshold=0.400; min_margin=0.400; object_uuid=fo-d592fd6b6ca80362

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
`prefLabel`	`[{'@value': 'Potassium 3-(acryloyloxy)propane-1-sulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}]`	`[{'@value': '2-bromo-4-chloropyridine', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'name:2-bromo-4-chloropyridine', 'https://pubchem.ncbi.nlm.nih.gov/compound/2762836'], 'prov:wasDerivedFrom': 'pubchem preferred label selection'}}]`	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=31098-20-1; set prefLabel for unique CAS in context using entropy rule; selected=pubchem; current_entropy=3.9682; pubchem_entropy=3.6897; current_score=4.3482; pubchem_score=3.8997; score_improvement=0.4485; threshold=0.400; min_margin=0.400; object_uuid=fo-d592fd6b6ca80362
`altLabel`	`None`	`[{'@value': 'Potassium 3-(acryloyloxy)propane-1-sulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}]`	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=31098-20-1; added current EF name as altLabel when prefLabel differs; object_uuid=fo-d592fd6b6ca80362
`altLabel`	`[{'@value': 'Potassium 3-(acryloyloxy)propane-1-sulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original EF name retained as altLabel'}}]`	[{'@value': '1-Propanesulfonic acid, 3-hydroxy-, acrylate, potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Propenoic acid, 3-sulfopropyl ester, potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Propenoic acid, 3-sulfopropyl ester, potassium salt (1:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-Sulfopropyl acrylate potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acrylic acid 3-sulfopropyl ester potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Acrylic acid, ester with 3-hydroxy-1-propanesulfonic acid potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Potassium 3-(acryloyloxy)-1-propanesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Potassium 3-acryloyloxypropanesulfonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Potassium 3-sulfopropyl acrylate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Ralu MER-SPA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'SPA-K', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Sulfopropyl acrylate potassium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:31098-20-1', 'https://commonchemistry.cas.org/detail?cas_rn=31098-20-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; cas=31098-20-1; added Common Chemistry CAS names as altLabel: 1-Propanesulfonic acid, 3-hydroxy-, acrylate, potassium salt, 2-Propenoic acid, 3-sulfopropyl ester, potassium salt, 2-Propenoic acid, 3-sulfopropyl ester, potassium salt (1:1), 3-Sulfopropyl acrylate potassium salt, Acrylic acid 3-sulfopropyl ester potassium salt, Acrylic acid, ester with 3-hydroxy-1-propanesulfonic acid potassium salt, Potassium 3-(acryloyloxy)-1-propanesulfonate, Potassium 3-acryloyloxypropanesulfonate, Potassium 3-sulfopropyl acrylate, Ralu MER-SPA, SPA-K, Sulfopropyl acrylate potassium salt; object_uuid=fo-d592fd6b6ca80362
`cas_match_labels`	`None`	`{'31098-20-1': 'exactMatch'}`	group_key=potassium3-(acryloyloxy)propane-1-sulfonate\|\|dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'31098-20-1': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-d592fd6b6ca80362: {'31098-20-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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