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Pentafluorobenzaldehyde

UUID 81bd34b6-1f80-4275-8999-ef3dc7fbb7bf
Flow Object IDfo-2b942f7412777879
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 653-37-2
EC Numbers 211-502-6
prefLabel
Language Value Provenance
en Pentafluorobenzaldehyde
altLabel ⓘ
Language Value Provenance
en 2,3,4,5,6-Pentafluorobenzaldehyde
en Benzaldehyde, 2,3,4,5,6-pentafluoro-
en Benzaldehyde, pentafluoro-
en Formylpentafluorobenzene
en NSC 96967
en Perfluorobenzaldehyde
References
Shared Properties
Predicate Value
InChIKey QJXCFMJTJYCLFG-UHFFFAOYSA-N, YIANRXVOCWAPDK-UHFFFAOYSA-N
InChI InChI=1S/C18H29N3O.2HNO3/c1-6-20-8-9-21(7-2)16(12-20)18(22)19-17-14(4)10-13(3)11-15(17)5;2*2-1(3)4/h10-11,16H,6-9,12H2,1-5H3,(H,19,22);2*(H,2,3,4), InChI=1S/C7HF5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h1H
IUPAC name 1,4-diethyl-N-(2,4,6-trimethylphenyl)-2-piperazinecarboxamide;bis(nitric acid), 1,4-diethyl-N-(2,4,6-trimethylphenyl)piperazine-2-carboxamide;bis(nitric acid), 1,4-diethyl-N-mesityl-piperazine-2-carboxamide;bis(nitric acid), 2,3,4,5,6-pentafluorobenzaldehyde, 2,3,4,5,6-pentakis(fluoranyl)benzaldehyde
Molecular formula C18H31N5O7, C7HF5O
SMILES C(=O)C1=C(C(=C(C(=C1F)F)F)F)F, CCN1CCN(C(C1)C(=O)NC2=C(C=C(C=C2C)C)C)CC.[N+](=O)(O)[O-].[N+](=O)(O)[O-]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 81bd34b6-1f80-4275-8999-ef3dc7fbb7bf pentafluorobenzaldehyde

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 pentafluorobenzaldehyde Emissions/Emissions to soil/Emissions to agricultural soil 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=pentafluorobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; cas=653-37-2; added Common Chemistry CAS names as altLabel: 2,3,4,5,6-Pentafluorobenzaldehyde, Benzaldehyde, 2,3,4,5,6-pentafluoro-, Benzaldehyde, pentafluoro-, Formylpentafluorobenzene, NSC 96967, Perfluorobenzaldehyde; object_uuid=fo-2b942f7412777879
cas_match_labels 1 — consensus_match group_key=pentafluorobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'653-37-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2b942f7412777879: {'653-37-2': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '2,3,4,5,6-Pentafluorobenzaldehyde', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzaldehyde, 2,3,4,5,6-pentafluoro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzaldehyde, pentafluoro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Formylpentafluorobenzene', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 96967', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Perfluorobenzaldehyde', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:653-37-2', 'https://commonchemistry.cas.org/detail?cas_rn=653-37-2'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=pentafluorobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; cas=653-37-2; added Common Chemistry CAS names as altLabel: 2,3,4,5,6-Pentafluorobenzaldehyde, Benzaldehyde, 2,3,4,5,6-pentafluoro-, Benzaldehyde, pentafluoro-, Formylpentafluorobenzene, NSC 96967, Perfluorobenzaldehyde; object_uuid=fo-2b942f7412777879
cas_match_labels None {'653-37-2': 'exactMatch'} group_key=pentafluorobenzaldehyde||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['ec_inventory', 'pubchem']; cas_sources={'653-37-2': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-2b942f7412777879: {'653-37-2': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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