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Barium Neodecanoate

UUID 1cd37173-3572-41e2-a748-0a9794c2371d
Flow Object IDfo-572e42b19b3a79a3
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 55172-98-0
EC Numbers 259-509-3
prefLabel
Language Value Provenance
en Barium Neodecanoate
altLabel ⓘ
Language Value Provenance
en Neodecanoic acid, barium salt
en Neodecanoic acid, barium salt (2:1)
References
Shared Properties
Predicate Value
InChIKey CJLKLWVNWFVXOI-UHFFFAOYSA-L, QJFWQPOUERXNAS-UHFFFAOYSA-L, RKGNDHKEOIXFST-UHFFFAOYSA-N, ROSHGJWNZDDJFF-UHFFFAOYSA-L, ZHJXIXXWMBEOSM-UHFFFAOYSA-L
InChI InChI=1S/2C10H20O2.Ba/c2*1-10(2,3)8-6-4-5-7-9(11)12;/h2*4-8H2,1-3H3,(H,11,12);/q;;+2/p-2, InChI=1S/2C10H20O2.Ba/c2*1-4-5-6-7-8-10(2,3)9(11)12;/h2*4-8H2,1-3H3,(H,11,12);/q;;+2/p-2, InChI=1S/2C10H20O2.Ba/c2*1-4-6-7-8-10(3,5-2)9(11)12;/h2*4-8H2,1-3H3,(H,11,12);/q;;+2/p-2, InChI=1S/2C10H20O2.Ba/c2*1-9(2,3)7-10(4,5)6-8(11)12;/h2*6-7H2,1-5H3,(H,11,12);/q;;+2/p-2, InChI=1S/C9H14N6S/c1-7-8(15-6-14-7)4-16-3-2-12-9(11)13-5-10/h6H,2-4H2,1H3,(H,14,15)(H3,11,12,13)
IUPAC name 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]guanidine, 1-cyano-2-[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethyl]guanidine, barium(2+);bis(2,2-dimethylcaprylate), barium(2+);bis(2,2-dimethyloctanoate), barium(2+);bis(2-ethyl-2-methyl-enanthate), barium(2+);bis(2-ethyl-2-methyl-heptanoate), barium(2+);bis(2-ethyl-2-methylheptanoate), barium(2+);bis(3,3,5,5-tetramethylhexanoate), barium(2+);bis(7,7-dimethylcaprylate), barium(2+);bis(7,7-dimethyloctanoate)
Molecular formula C20H38BaO4, C9H14N6S
SMILES CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].[Ba+2], CC(C)(C)CCCCCC(=O)[O-].CC(C)(C)CCCCCC(=O)[O-].[Ba+2], CC1=C(N=CN1)CSCCN=C(N)NC#N, CCCCCC(C)(CC)C(=O)[O-].CCCCCC(C)(CC)C(=O)[O-].[Ba+2], CCCCCCC(C)(C)C(=O)[O-].CCCCCCC(C)(C)C(=O)[O-].[Ba+2]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 1cd37173-3572-41e2-a748-0a9794c2371d barium neodecanoate

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 barium neodecanoate Emissions/Emissions to soil/Emissions to non-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=bariumneodecanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=55172-98-0; added Common Chemistry CAS names as altLabel: Neodecanoic acid, barium salt, Neodecanoic acid, barium salt (2:1); object_uuid=fo-572e42b19b3a79a3
cas_match_labels 1 — consensus_match group_key=bariumneodecanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'55172-98-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-572e42b19b3a79a3: {'55172-98-0': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': 'Neodecanoic acid, barium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:55172-98-0', 'https://commonchemistry.cas.org/detail?cas_rn=55172-98-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Neodecanoic acid, barium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:55172-98-0', 'https://commonchemistry.cas.org/detail?cas_rn=55172-98-0'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=bariumneodecanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=55172-98-0; added Common Chemistry CAS names as altLabel: Neodecanoic acid, barium salt, Neodecanoic acid, barium salt (2:1); object_uuid=fo-572e42b19b3a79a3
cas_match_labels None {'55172-98-0': 'exactMatch'} group_key=bariumneodecanoate||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory', 'pubchem']; cas_sources={'55172-98-0': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-572e42b19b3a79a3: {'55172-98-0': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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