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Butonate

UUID d6c276b5-8fe5-43da-97e0-01e9d8c0598d
Deprecated yes
Replaced By 6a4d3ed6-7fbe-45aa-b5a9-07011a45fe53
Flow Object IDfo-7abe693d6d6740ed
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 126-22-7
EC Numbers 204-778-4
prefLabel
Language Value Provenance
en Butonate
altLabel ⓘ
Language Value Provenance
en <em>O</em>,<em>O</em>-Dimethyl 2,2,2-trichloro-1-(<em>n</em>-butyryloxy)ethylphosphonate
en <em>O</em>,<em>O</em>-Dimethyl-(1-butyryloxy-2,2,2-trichloroethyl) phosphonate
en Butanoic acid, 2,2,2-trichloro-1-(dimethoxyphosphinyl)ethyl ester
en Butyric acid, ester with dimethyl (2,2,2-trichloro-1-hydroxyethyl)phosphonate
en Dimethoxy-2,2,2-trichloro-1-<em>n</em>-butyryloxy-ethylphosphine oxide
en Dimethyl 2,2,2-trichloro-1-<em>n</em>-butyryloxyethylphosphonate
en ENT 20852
en F 139
en Fekama AT 50
en NSC 17872
en Pedix PE 50
en Pedix-50
en Pedix-butonate
en T 113
en Tribufon
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey BKAQXYNWONVOAX-UHFFFAOYSA-N
InChI InChI=1S/C8H14Cl3O5P/c1-4-5-6(12)16-7(8(9,10)11)17(13,14-2)15-3/h7H,4-5H2,1-3H3
IUPAC name (2,2,2-trichloro-1-dimethoxyphosphoryl-ethyl) butanoate, (2,2,2-trichloro-1-dimethoxyphosphorylethyl) butanoate, [2,2,2-tris(chloranyl)-1-dimethoxyphosphoryl-ethyl] butanoate, butanoic acid (2,2,2-trichloro-1-dimethoxyphosphorylethyl) ester, butyric acid (2,2,2-trichloro-1-dimethoxyphosphoryl-ethyl) ester
Molecular formula C8H14Cl3O5P
Molecular mass 327.528
Monoisotopic mass 325.96444
SMILES CCCC(=O)OC(C(Cl)(Cl)Cl)P(=O)(OC)OC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 d6c276b5-8fe5-43da-97e0-01e9d8c0598d butonate

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=butonate||dimension=Environmental > media=Water > water_body=Ocean; cas=126-22-7; added Common Chemistry CAS names as altLabel: <em>O</em>,<em>O</em>-Dimethyl 2,2,2-trichloro-1-(<em>n</em>-butyryloxy)ethylphosphonate, <em>O</em>,<em>O</em>-Dimethyl-(1-butyryloxy-2,2,2-trichloroethyl) phosphonate, Butanoic acid, 2,2,2-trichloro-1-(dimethoxyphosphinyl)ethyl ester, Butyric acid, ester with dimethyl (2,2,2-trichloro-1-hydroxyethyl)phosphonate, Dimethoxy-2,2,2-trichloro-1-<em>n</em>-butyryloxy-ethylphosphine oxide, Dimethyl 2,2,2-trichloro-1-<em>n</em>-butyryloxyethylphosphonate, ENT 20852, F 139, Fekama AT 50, NSC 17872, Pedix PE 50, Pedix-50, Pedix-butonate, T 113, Tribufon; object_uuid=fo-7abe693d6d6740ed
cas_match_labels 1 — consensus_match group_key=butonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'126-22-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7abe693d6d6740ed: {'126-22-7': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '<em>O</em>,<em>O</em>-Dimethyl 2,2,2-trichloro-1-(<em>n</em>-butyryloxy)ethylphosphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>O</em>,<em>O</em>-Dimethyl-(1-butyryloxy-2,2,2-trichloroethyl) phosphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butanoic acid, 2,2,2-trichloro-1-(dimethoxyphosphinyl)ethyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyric acid, ester with dimethyl (2,2,2-trichloro-1-hydroxyethyl)phosphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dimethoxy-2,2,2-trichloro-1-<em>n</em>-butyryloxy-ethylphosphine oxide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dimethyl 2,2,2-trichloro-1-<em>n</em>-butyryloxyethylphosphonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'ENT 20852', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'F 139', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Fekama AT 50', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 17872', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pedix PE 50', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pedix-50', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Pedix-butonate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'T 113', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Tribufon', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:126-22-7', 'https://commonchemistry.cas.org/detail?cas_rn=126-22-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=butonate||dimension=Environmental > media=Water > water_body=Ocean; cas=126-22-7; added Common Chemistry CAS names as altLabel: <em>O</em>,<em>O</em>-Dimethyl 2,2,2-trichloro-1-(<em>n</em>-butyryloxy)ethylphosphonate, <em>O</em>,<em>O</em>-Dimethyl-(1-butyryloxy-2,2,2-trichloroethyl) phosphonate, Butanoic acid, 2,2,2-trichloro-1-(dimethoxyphosphinyl)ethyl ester, Butyric acid, ester with dimethyl (2,2,2-trichloro-1-hydroxyethyl)phosphonate, Dimethoxy-2,2,2-trichloro-1-<em>n</em>-butyryloxy-ethylphosphine oxide, Dimethyl 2,2,2-trichloro-1-<em>n</em>-butyryloxyethylphosphonate, ENT 20852, F 139, Fekama AT 50, NSC 17872, Pedix PE 50, Pedix-50, Pedix-butonate, T 113, Tribufon; object_uuid=fo-7abe693d6d6740ed
cas_match_labels None {'126-22-7': 'exactMatch'} group_key=butonate||dimension=Environmental > media=Water > water_body=Ocean; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'126-22-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7abe693d6d6740ed: {'126-22-7': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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