Heptanoyl Chloride

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UUID 77065adc-25f3-4c2e-9465-a6822e9f989d

Flow Object ID fo-c65037f99596a466

Source EF 3.1

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

CAS Numbers 2528-61-2

EC Numbers 219-775-3

prefLabel

Language	Value	Provenance
`en`	`Heptanoyl Chloride`

altLabel ⓘ

Language	Value	Provenance
`en`	`<em>n</em>-Heptanoyl chloride`
`en`	`Enanthoyl chloride`
`en`	`Enanthyl chloride`
`en`	`Heptanoic acid chloride`

References

Shared Properties

Predicate	Value
InChIKey	`BCIIWQHRWPXARK-UHFFFAOYSA-N, UCVODTZQZHMTPN-UHFFFAOYSA-N`
InChI	`InChI=1S/C5H9NO/c1-2-6-5(1)3-7-4-5/h6H,1-4H2, InChI=1S/C7H13ClO/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3`
IUPAC name	`6-oxa-1-azaspiro[3.3]heptane, enanthyl chloride, heptanoyl chloride`
Molecular formula	`C5H9NO, C7H13ClO`
SMILES	`C1CNC12COC2, CCCCCCC(=O)Cl`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`77065adc-25f3-4c2e-9465-a6822e9f989d`	heptanoyl chloride

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	heptanoyl chloride	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=heptanoylchloride\|\|dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=2528-61-2; added Common Chemistry CAS names as altLabel: <em>n</em>-Heptanoyl chloride, Enanthoyl chloride, Enanthyl chloride, Heptanoic acid chloride; object_uuid=fo-c65037f99596a466
`cas_match_labels`	1	`—`	consensus_match	group_key=heptanoylchloride\|\|dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2528-61-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c65037f99596a466: {'2528-61-2': '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`	`None`	[{'@value': '<em>n</em>-Heptanoyl chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2528-61-2', 'https://commonchemistry.cas.org/detail?cas_rn=2528-61-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Enanthoyl chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2528-61-2', 'https://commonchemistry.cas.org/detail?cas_rn=2528-61-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Enanthyl chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2528-61-2', 'https://commonchemistry.cas.org/detail?cas_rn=2528-61-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Heptanoic acid chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:2528-61-2', 'https://commonchemistry.cas.org/detail?cas_rn=2528-61-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=heptanoylchloride\|\|dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=2528-61-2; added Common Chemistry CAS names as altLabel: <em>n</em>-Heptanoyl chloride, Enanthoyl chloride, Enanthyl chloride, Heptanoic acid chloride; object_uuid=fo-c65037f99596a466
`cas_match_labels`	`None`	`{'2528-61-2': 'exactMatch'}`	group_key=heptanoylchloride\|\|dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'2528-61-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-c65037f99596a466: {'2528-61-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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