Consensus flow list

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

fo-76717d987624b299

Identity

Type
MolecularComplex
CAS
6485-34-3
EC
229-349-9
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

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

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GSHUZVSNIBLGMR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C7H5NO3S.Ca/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,9);
IUPAC name chemrof:IUPAC_name 1,2-benzisothiazol-3(2h)-one 1,1-dioxide, Calcium Salt
Molecular formula chemrof:molecular_formula C7H5CaNO3S
Molecular mass chemrof:molecular_mass 223.266
Monoisotopic mass chemrof:monoisotopic_mass 222.961605
SMILES string chemrof:smiles_string O=C1NS(=O)(=O)c2ccccc21.[Ca]

Known URLs

3

Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.

Resource URL Recorded by
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=6485-34-3 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/66584623 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q126605587 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f6e4c982-cb26-49d3-befb-e397ed6cd417 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
9b381fcd-2c4a-44c5-ab0e-a6cbface6b85 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
2131a88d-69f8-4fc5-896c-9ea46db75178 Environmental → Air → Indoor EF 3.1 kg 0
8f75ec47-642b-4d66-8f66-9facf0b1f446 Environmental → Air → Long-term EF 3.1 kg 0
02d9e8ab-b3ef-4208-9db0-844a9055467f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
66ec24ea-d435-4f2a-84b1-9e6c12c6d09f Environmental → Air → Unknown EF 3.1 kg 0
7c20e216-0b8d-401f-859e-08ff86e3d374 Environmental → Ground → Agricultural EF 3.1 kg 0
a3653994-3b65-41b0-b02d-3c1747d78159 Environmental → Ground → Non-agricultural EF 3.1 kg 0
1a48e6cd-1224-4c46-b09c-8f0969e80eab Environmental → Ground → Unknown EF 3.1 kg 0
0343c729-c743-40ba-b5c4-6722f6079deb Environmental → Water → Long-term EF 3.1 kg 0
8e6a9eba-e3b2-49ab-9d2e-2e2e8ef7cb3a Environmental → Water → Ocean EF 3.1 kg 0
696e01e1-800d-4e40-b057-3de012d46863 Environmental → Water → Surface water EF 3.1 kg 0
3f9967ee-4b03-41d9-a9fb-98ccd2f561e4 Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON 
{
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}

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