Consensus flow list

Identity

Type
Chemical salt
CAS
67109-27-7
EC
266-577-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Sodium Bis[2-chloro-4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1h-pyrazol-4-yl)azo]-5-hydroxybenzenesulphonamidato(2-)]chromate(1-)

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string MTEWSKPSJGGDQE-UHFFFAOYSA-J
InChI2D string chemrof:inchi2d_string InChI=1S/2C16H14ClN5O4S.Cr.Na/c2*1-9-15(16(24)22(21-9)10-5-3-2-4-6-10)20-19-12-7-11(17)14(8-13(12)23)27(18,25)26;;/h2*2-8,23-24H,1H3,(H2,18,25,26);;/q;;+3;+1/p-4
IUPAC name chemrof:IUPAC_name chromic;sodium;bis(4-(5-chloro-2-oxido-4-sulfamoyl-phenyl)azo-3-methyl-1-phenyl-pyrazol-5-olate), sodium;bis(4-(5-chloro-2-oxido-4-sulfamoylphenyl)azo-3-methyl-1-phenyl-5-pyrazololate);chromium(3+), sodium;bis(4-[(5-chloranyl-2-oxidanidyl-4-sulfamoyl-phenyl)diazenyl]-3-methyl-1-phenyl-pyrazol-5-olate);chromium(3+), sodium;bis(4-[(5-chloro-2-oxido-4-sulfamoylphenyl)diazenyl]-3-methyl-1-phenylpyrazol-5-olate);chromium(3+)
Molecular formula chemrof:molecular_formula C32H24Cl2CrN10NaO8S2
Molecular mass chemrof:molecular_mass 886.632
Monoisotopic mass chemrof:monoisotopic_mass 884.989982
SMILES string chemrof:smiles_string CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.CC1=NN(C(=C1N=NC2=CC(=C(C=C2[O-])S(=O)(=O)N)Cl)[O-])C3=CC=CC=C3.[Na+].[Cr+3]

Known URLs

5

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=67109-27-7 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.060.506 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID301015021 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3LBB41R06C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/163134 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
1200e674-ced2-4cef-8239-e542072cdf51 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
42ffd123-4299-4c79-956b-46ddf7c8bd5a Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
0a558854-8606-429c-b9ec-782ae68f600a Environmental → Air → Indoor EF 3.1 kg 2
1c9be727-da48-46ee-8a4d-6dd9d5af44a1 Environmental → Air → Long-term EF 3.1 kg 0
40ae152d-78e9-4eaa-bfe2-1a119aff5f06 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
46cd9b25-27fd-4d11-9480-73e20bf057ba Environmental → Air → Unknown EF 3.1 kg 2
d5d07320-3cbd-4c18-a1ef-1009d6e116ba Environmental → Ground → Agricultural EF 3.1 kg 2
2dad0e20-3dec-4b58-9bf7-ec8ab9ce1556 Environmental → Ground → Non-agricultural EF 3.1 kg 2
57ae50da-3878-49b2-aca5-69dc7ffca261 Environmental → Ground → Unknown EF 3.1 kg 2
3847fb1a-6a95-414e-a521-27c8427689ab Environmental → Water → Long-term EF 3.1 kg 0
4c66fe43-28be-42e0-b696-0821e4f0cfa3 Environmental → Water → Ocean EF 3.1 kg 0
a576cd16-5563-4ed6-8e26-695131a6e249 Environmental → Water → Surface water EF 3.1 kg 2
22296930-c2c2-4457-8e17-95c15668bd12 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
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