Butyl Isocyanate

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UUID 1669f9f7-0218-4604-a528-d67efe2a95ba

Flow Object ID fo-22cd59e2157d7d1b

Source EF 3.1

Context Environmental → Air → Ground level → Urban (>1000 people/square mile)

CAS Numbers 111-36-4

EC Numbers 203-862-8

prefLabel

Language	Value	Provenance
`en`	`Butyl Isocyanate`

altLabel ⓘ

Language	Value	Provenance
`en`	`1-Butyl isocyanate`
`en`	`1-isocyanatobutane`
`en`	`BIC`
`en`	`N-Butyl isocyanate`
`en`	`<em>n</em>-Butyl isocyanate`
`en`	`Butane, 1-isocyanato-`
`en`	`Isocyanic acid, butyl ester`

Definitions

Language	Value	Provenance
`en`	An isocyanate having a butyl group attached to the nitrogen.

References

Shared Properties

Predicate	Value
Formal charge	`0`
InChIKey	`HNHVTXYLRVGMHD-UHFFFAOYSA-N`
InChI	`InChI=1S/C5H9NO/c1-2-3-4-6-5-7/h2-4H2,1H3`
IUPAC name	`1-isocyanatobutane`
Molecular formula	`C5H9NO`
Molecular mass	`99.133`
Monoisotopic mass	`99.06841`
SMILES	`CCCCN=C=O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`1669f9f7-0218-4604-a528-d67efe2a95ba`	butyl isocyanate

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	butyl isocyanate	Emissions/Emissions to air/Emissions to urban air close to ground	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=butylisocyanate\|\|dimension=Environmental > media=Water > water_body=Ocean; cas=111-36-4; added Common Chemistry CAS names as altLabel: <em>n</em>-Butyl isocyanate, Butane, 1-isocyanato-, Isocyanic acid, butyl ester; object_uuid=fo-22cd59e2157d7d1b
`cas_match_labels`	1	`—`	consensus_match	group_key=butylisocyanate\|\|dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-36-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-22cd59e2157d7d1b: {'111-36-4': 'exactMatch'}

Context Attributes

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

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	[{'@value': '1-Butyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Butyl isocyanate', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-isocyanatobutane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-isocyanatobutane', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'BIC', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:BIC', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N-Butyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N-Butyl isocyanate', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}]	[{'@value': '1-Butyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-Butyl isocyanate', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1-isocyanatobutane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:1-isocyanatobutane', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'BIC', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:BIC', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'N-Butyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:N-Butyl isocyanate', 'http://purl.obolibrary.org/obo/CHEBI_136519', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '<em>n</em>-Butyl isocyanate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-36-4', 'https://commonchemistry.cas.org/detail?cas_rn=111-36-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butane, 1-isocyanato-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-36-4', 'https://commonchemistry.cas.org/detail?cas_rn=111-36-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Isocyanic acid, butyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:111-36-4', 'https://commonchemistry.cas.org/detail?cas_rn=111-36-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=butylisocyanate\|\|dimension=Environmental > media=Water > water_body=Ocean; cas=111-36-4; added Common Chemistry CAS names as altLabel: <em>n</em>-Butyl isocyanate, Butane, 1-isocyanato-, Isocyanic acid, butyl ester; object_uuid=fo-22cd59e2157d7d1b
`cas_match_labels`	`None`	`{'111-36-4': 'exactMatch'}`	group_key=butylisocyanate\|\|dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'111-36-4': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-22cd59e2157d7d1b: {'111-36-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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  "unit": "kg",
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