1,1,3-trichloroacetone

← Back to consensus flows

UUID 1be43592-fc56-4cdd-b683-de42ca195849

Flow Object ID fo-3d12b7de3f6a7b65

Source EF 3.1

Context Environmental → Ground → Unknown

CAS Numbers 921-03-9

EC Numbers 213-063-6

prefLabel

Language	Value	Provenance
`en`	`1,1,3-trichloroacetone`

altLabel ⓘ

Language	Value	Provenance
`en`	`1,1,2-Trichloroacetone`
`en`	`1,1,3-Trichloro-2-propanone`
`en`	`2-Propanone, 1,1,3-trichloro-`
`en`	`α,α′,α′-Trichloroacetone`

References

Shared Properties

Predicate	Value
InChIKey	`MQGDQAFIJRAXGI-UHFFFAOYSA-N, ZWILTCXCTVMANU-UHFFFAOYSA-N`
InChI	`InChI=1S/C20H21NO4/c21-11-5-10-17(19(22)23)20(24)25-12-18-15-8-3-1-6-13(15)14-7-2-4-9-16(14)18/h1-4,6-9,17-18H,5,10-12,21H2,(H,22,23), InChI=1S/C3H3Cl3O/c4-1-2(7)3(5)6/h3H,1H2`
IUPAC name	`1,1,3-trichloro-2-propanone, 1,1,3-trichloroacetone, 1,1,3-trichloropropan-2-one, 1,1,3-tris(chloranyl)propan-2-one, 5-amino-2-(9H-fluoren-9-ylmethoxycarbonyl)pentanoic acid, 5-amino-2-(9H-fluoren-9-ylmethoxycarbonyl)valeric acid, 5-amino-2-[9H-fluoren-9-ylmethoxy(oxo)methyl]pentanoic acid, 5-azanyl-2-(9H-fluoren-9-ylmethoxycarbonyl)pentanoic acid`
Molecular formula	`C20H21NO4, C3H3Cl3O`
SMILES	`C(C(=O)C(Cl)Cl)Cl, C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)C(CCCN)C(=O)O`

Source List References

List	Version	Source Flow UUID	Source Flow Name
EF	3.1	`1be43592-fc56-4cdd-b683-de42ca195849`	1,1,3-trichloroacetone

Concept Associations

Source List	Source Flow	Source Context	Unit	Match Type	Conversion	Provenance
EF 3.1	1,1,3-trichloroacetone	Emissions/Emissions to soil/Emissions to soil, unspecified	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=1,1,3-trichloroacetone\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=921-03-9; added Common Chemistry CAS names as altLabel: 1,1,2-Trichloroacetone, 1,1,3-Trichloro-2-propanone, 2-Propanone, 1,1,3-trichloro-, α,α′,α′-Trichloroacetone; object_uuid=fo-3d12b7de3f6a7b65
`cas_match_labels`	1	`—`	consensus_match	group_key=1,1,3-trichloroacetone\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'921-03-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3d12b7de3f6a7b65: {'921-03-9': 'exactMatch'}

Context Attributes

Attribute	Value
dimension	Environmental
media	Ground
geography	Unknown

Consensus Changes

Field	Old Value	New Value	Comment
`altLabel`	`None`	[{'@value': '1,1,2-Trichloroacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:921-03-9', 'https://commonchemistry.cas.org/detail?cas_rn=921-03-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,1,3-Trichloro-2-propanone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:921-03-9', 'https://commonchemistry.cas.org/detail?cas_rn=921-03-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Propanone, 1,1,3-trichloro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:921-03-9', 'https://commonchemistry.cas.org/detail?cas_rn=921-03-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α,α′,α′-Trichloroacetone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:921-03-9', 'https://commonchemistry.cas.org/detail?cas_rn=921-03-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}]	group_key=1,1,3-trichloroacetone\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=921-03-9; added Common Chemistry CAS names as altLabel: 1,1,2-Trichloroacetone, 1,1,3-Trichloro-2-propanone, 2-Propanone, 1,1,3-trichloro-, α,α′,α′-Trichloroacetone; object_uuid=fo-3d12b7de3f6a7b65
`cas_match_labels`	`None`	`{'921-03-9': 'exactMatch'}`	group_key=1,1,3-trichloroacetone\|\|dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['ec_inventory', 'pubchem']; cas_sources={'921-03-9': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-3d12b7de3f6a7b65: {'921-03-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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