Consensus flow list

Identity

Type
Chemical salt
CAS
7023-61-2
EC
230-303-5
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for Calcium 4-[(5-chloro-4-methyl-2-sulfonatophenyl)diazenyl]-3-hydroxy-2-naphthoate

Alternative labels

49

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string KCAQGUXPIKJXTQ-UHFFFAOYSA-L, PHFMCOUQHQMESB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C18H13ClN2O6S.Ca/c1-9-6-15(28(25,26)27)14(8-13(9)19)20-21-16-11-5-3-2-4-10(11)7-12(17(16)22)18(23)24;/h2-8,22H,1H3,(H,23,24)(H,25,26,27);/q;+2/p-2
IUPAC name chemrof:IUPAC_name Calcium 4-[(5-chloro-4-methyl-2-sulfonatophenyl)diazenyl]-3-hydroxy-2-naphthoate
Molecular formula chemrof:molecular_formula C18H11CaClN2O6S, C18H13CaClN2O6S
SMILES string chemrof:smiles_string Cc1cc(S(=O)(=O)[O-])c(N=Nc2c(O)c(C(=O)[O-])cc3ccccc23)cc1Cl.[Ca+2]

Known URLs

2

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=7023-61-2 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/136467915 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
b16514e2-019a-4d7e-8474-c8b307723dc1 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
687345a0-b882-4925-8b37-2775bd03e125 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
81946e5d-980b-4fb6-b9c9-a4975526c668 Environmental → Air → Indoor EF 3.1 kg 4
69e4f1aa-bda2-4c56-bd4c-54f35dfc7d26 Environmental → Air → Long-term EF 3.1 kg 0
2de8704b-e751-4097-99f0-82afa6e75e3a Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
c3492082-bd16-4215-84e1-d436d7280584 Environmental → Air → Unknown EF 3.1 kg 4
75ccda7f-78c9-44b0-9a7b-bbf23e6aca81 Environmental → Ground → Agricultural EF 3.1 kg 4
7ec7767a-9e2e-4c65-9b10-1d261862c9bc Environmental → Ground → Non-agricultural EF 3.1 kg 4
546221b2-0d77-4139-9146-51c40badbaa8 Environmental → Ground → Unknown EF 3.1 kg 4
632bc3d7-1019-42db-866d-00cd911f435d Environmental → Water → Long-term EF 3.1 kg 0
aa6738d1-ba03-4ff9-9816-96f80736044e Environmental → Water → Ocean EF 3.1 kg 4
564a5c88-5ce1-4ed5-bbef-1d8a89832a19 Environmental → Water → Surface water EF 3.1 kg 4
fa89cc96-4786-4794-8f34-faced31acd4e Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
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  ],
  "altLabel": [
    {
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      "@value": "2-Naphthalenecarboxylic acid, 4-[2-(5-chloro-4-methyl-2-sulfophenyl)diazenyl]-3-hydroxy-, calcium salt (1:1)",
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      "@value": "2-Naphthoic acid, 4-(5-chloro-2-sulfo-p-tolylazo)-3-hydroxy-, calcium salt",
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