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1,2-benzisothiazol-3(2h)-one 1,1-dioxide, Calcium Salt

UUID 1a48e6cd-1224-4c46-b09c-8f0969e80eab
Flow Object IDfo-76717d987624b299
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 6485-34-3
EC Numbers 229-349-9
prefLabel
Language Value Provenance
en 1,2-benzisothiazol-3(2h)-one 1,1-dioxide, Calcium Salt
altLabel
Language Value Provenance
en 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt
en 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt (2:1)
en 1,2-Benzisothiazolin-3-one, 1,1-dioxide, calcium salt
en Calcium <em>o</em>-benzolsulfimide
en Calcium saccharin
en Calcium saccharinate
en Saccharin calcium salt
en Sweet'n Low
References
Shared Properties
Predicate Value
InChIKey BRWLYWGIEMGRGS-UHFFFAOYSA-N, FXFHIECJDPMSDG-UHFFFAOYSA-N, GSHUZVSNIBLGMR-UHFFFAOYSA-N, LNMAXKMUGYXKPJ-UHFFFAOYSA-L, MQRKKLAGBPVXCD-UHFFFAOYSA-L, NNOYLBKZPCUCQT-UHFFFAOYSA-L
InChI InChI=1S/2C7H5NO3S.Ca.7H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;;;;;;/h2*1-4H,(H,8,9);;7*1H2/q;;+2;;;;;;;/p-2, InChI=1S/2C7H5NO3S.Ca.H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;/h2*1-4H,(H,8,9);;1H2/q;;+2;/p-2, InChI=1S/2C7H5NO3S.Ca/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h2*1-4H,(H,8,9);, InChI=1S/2C7H5NO3S.Ca/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h2*1-4H,(H,8,9);/q;;+2/p-2, InChI=1S/C7H5NO3S.Ca/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,9);, InChI=1S/C7H5NO3S.Ca/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,9);/q;+2
IUPAC name calcium 1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one, calcium 1,1-diketo-1,2-benzothiazol-3-one, calcium 1,1-dioxo-1,2-benzothiazol-3-one, calcium bis(1,1-bis(oxidanylidene)-1,2-benzothiazol-2-id-3-one), calcium bis(1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate), calcium bis(1,1-diketo-1,2-benzothiazol-2-id-3-one), calcium bis(1,1-diketo-1,2-benzothiazol-3-olate), calcium bis(1,1-dioxo-1,2-benzothiazol-2-id-3-one), calcium bis(1,1-dioxo-1,2-benzothiazol-3-olate), calcium;bis(1,1-bis(oxidanylidene)-1,2-benzothiazol-2-id-3-one);hydrate, calcium;bis(1,1-bis(oxidanylidene)-1,2-benzothiazol-3-olate);heptahydrate, calcium;bis(1,1-diketo-1,2-benzothiazol-2-id-3-one);hydrate, calcium;bis(1,1-diketo-1,2-benzothiazol-3-olate);heptahydrate, calcium;bis(1,1-dioxo-1,2-benzothiazol-2-id-3-one);hydrate, calcium;bis(1,1-dioxo-1,2-benzothiazol-3-olate);heptahydrate
Molecular formula C14H10CaN2O6S2, C14H10CaN2O7S2, C14H22CaN2O13S2, C14H8CaN2O6S2, C7H5CaNO3S, C7H5CaNO3S+2
SMILES C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].O.O.O.O.O.O.O.[Ca+2], C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].C1=CC=C2C(=C1)C(=NS2(=O)=O)[O-].[Ca+2], C1=CC=C2C(=C1)C(=O)NS2(=O)=O.C1=CC=C2C(=C1)C(=O)NS2(=O)=O.[Ca], C1=CC=C2C(=C1)C(=O)NS2(=O)=O.[Ca+2], C1=CC=C2C(=C1)C(=O)NS2(=O)=O.[Ca], C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.O.[Ca+2], C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[Ca+2]

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 1a48e6cd-1224-4c46-b09c-8f0969e80eab 1,2-benzisothiazol-3(2h)-one 1,1-dioxide, calcium salt

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 1,2-benzisothiazol-3(2h)-one 1,1-dioxide, calcium salt 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=1,2-benzisothiazol-3(2h)-one1,1-dioxide,calciumsalt||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=6485-34-3; added Common Chemistry CAS names as altLabel: 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt, 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt (2:1), 1,2-Benzisothiazolin-3-one, 1,1-dioxide, calcium salt, Calcium <em>o</em>-benzolsulfimide, Calcium saccharin, Calcium saccharinate, Saccharin calcium salt, Sweet'n Low; object_uuid=fo-76717d987624b299
cas_match_labels 1 consensus_match group_key=1,2-benzisothiazol-3(2h)-one1,1-dioxide,calciumsalt||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'6485-34-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-76717d987624b299: {'6485-34-3': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt (2:1)', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,2-Benzisothiazolin-3-one, 1,1-dioxide, calcium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium <em>o</em>-benzolsulfimide', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium saccharin', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Calcium saccharinate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Saccharin calcium salt', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': "Sweet'n Low", '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:6485-34-3', 'https://commonchemistry.cas.org/detail?cas_rn=6485-34-3'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=1,2-benzisothiazol-3(2h)-one1,1-dioxide,calciumsalt||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=6485-34-3; added Common Chemistry CAS names as altLabel: 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt, 1,2-Benzisothiazol-3(2<em>H</em>)-one, 1,1-dioxide, calcium salt (2:1), 1,2-Benzisothiazolin-3-one, 1,1-dioxide, calcium salt, Calcium <em>o</em>-benzolsulfimide, Calcium saccharin, Calcium saccharinate, Saccharin calcium salt, Sweet'n Low; object_uuid=fo-76717d987624b299
cas_match_labels None {'6485-34-3': 'exactMatch'} group_key=1,2-benzisothiazol-3(2h)-one1,1-dioxide,calciumsalt||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['ec_inventory']; cas_sources={'6485-34-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-76717d987624b299: {'6485-34-3': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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