Hexadecanoyl Chloride

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UUID d544ccc5-8c30-4154-80da-f11340e9b3df

Flow Object ID fo-f691fec2f5399bb4

Source EF 3.1

Context Environmental → Air → Unknown

CAS Numbers 112-67-4

EC Numbers 203-996-7

prefLabel

Language	Value	Provenance
`en`	`Hexadecanoyl Chloride`

altLabel ⓘ

Language	Value	Provenance
`en`	`Hexadecanoic acid chloride`
`en`	`NSC 9854`
`en`	`Palmitic acid chloride`
`en`	`Palmitic chloride`
`en`	`Palmitoyl chloride`
`en`	`Palmityl acid chloride`

References

Shared Properties

Predicate	Value
InChIKey	`ARBOVOVUTSQWSS-UHFFFAOYSA-N, GPNXSRRDVWDUSE-UHFFFAOYSA-N, RWNJOXUVHRXHSD-UHFFFAOYSA-N`
InChI	`InChI=1S/2C16H31ClO/c21-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h22-15H2,1H3, InChI=1S/C16H31ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3, InChI=1S/C7H12O2/c1-2-3-4-5-6-7(8)9/h2H,1,3-6H2,(H,8,9)`
IUPAC name	`6-heptenoic acid, hept-6-enoic acid, hexadecanoyl chloride, palmityl chloride`
Molecular formula	`C16H31ClO, C32H62Cl2O2, C7H12O2`
SMILES	`C=CCCCCC(=O)O, CCCCCCCCCCCCCCCC(=O)Cl, CCCCCCCCCCCCCCCC(=O)Cl.CCCCCCCCCCCCCCCC(=O)Cl`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`d544ccc5-8c30-4154-80da-f11340e9b3df`	hexadecanoyl chloride

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	hexadecanoyl chloride	Emissions/Emissions to air/Emissions to air, indoor	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=hexadecanoylchloride\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=112-67-4; added Common Chemistry CAS names as altLabel: Hexadecanoic acid chloride, NSC 9854, Palmitic acid chloride, Palmitic chloride, Palmitoyl chloride, Palmityl acid chloride; object_uuid=fo-f691fec2f5399bb4
`cas_match_labels`	1	`—`	consensus_match	group_key=hexadecanoylchloride\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'112-67-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f691fec2f5399bb4: {'112-67-4': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Air
indoor	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': 'Hexadecanoic acid chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 9854', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Palmitic acid chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Palmitic chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Palmitoyl chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Palmityl acid chloride', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:112-67-4', 'https://commonchemistry.cas.org/detail?cas_rn=112-67-4'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=hexadecanoylchloride\|\|dimension=Environmental > media=Water > water_body=Unknown; cas=112-67-4; added Common Chemistry CAS names as altLabel: Hexadecanoic acid chloride, NSC 9854, Palmitic acid chloride, Palmitic chloride, Palmitoyl chloride, Palmityl acid chloride; object_uuid=fo-f691fec2f5399bb4
`cas_match_labels`	`None`	`{'112-67-4': 'exactMatch'}`	group_key=hexadecanoylchloride\|\|dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'112-67-4': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-f691fec2f5399bb4: {'112-67-4': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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