Consensus flow list

Ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, Ammonium (1:2), (pb-7-11'-121'3'3)

fo-c1fc96fabd9af414

Identity

Type
Chemical salt
CAS
68413-60-5
EC
270-232-7
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, Ammonium (1:2), (pb-7-11'-121'3'3)

Alternative labels

3

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string AIQSLKRBXVNXIQ-UHFFFAOYSA-K
InChI2D string chemrof:inchi2d_string InChI=1S/C10H16N2O8.Fe.2H3N.H2O/c13-7(14)3-11(4-8(15)16)1-2-12(5-9(17)18)6-10(19)20;;;;/h1-6H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20);;2*1H3;1H2/q;+3;;;/p-3
IUPAC name chemrof:IUPAC_name diammonium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+);hydroxide, diammonium;ferric;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;hydroxide, diazanium;2-[2-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethyl-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate;iron(3+);hydroxide, diazanium;2-[2-[bis(carboxylatomethyl)amino]ethyl-(carboxylatomethyl)amino]acetate;iron(3+);hydroxide
Molecular formula chemrof:molecular_formula C10H21FeN4O9
Molecular mass chemrof:molecular_mass 397.142
Monoisotopic mass chemrof:monoisotopic_mass 397.065791
SMILES string chemrof:smiles_string C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[NH4+].[NH4+].[OH-].[Fe+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=68413-60-5 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.063.828 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3071517 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/139594169 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81999181 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
13c55210-8853-427c-8cf0-3c68249f0983 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
b1c36198-1410-496b-9a22-602374f48d53 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
823a1cff-f5d8-4e05-8185-eeb541a44f72 Environmental → Air → Indoor EF 3.1 kg 2
082ede83-979d-4cb6-81ba-381ab827f2e2 Environmental → Air → Long-term EF 3.1 kg 0
9acd1864-8f91-40d5-9838-097320253b1b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
9dac584f-64b1-4074-bb8d-0f1b8f7b34ac Environmental → Air → Unknown EF 3.1 kg 2
b6cd96e7-658b-4447-a2bb-fcae9449bd99 Environmental → Ground → Agricultural EF 3.1 kg 2
286d9f0a-5932-4112-90b0-2ac68a218fe6 Environmental → Ground → Non-agricultural EF 3.1 kg 2
c7027353-8369-4bff-afcc-b8ddf5a0b218 Environmental → Ground → Unknown EF 3.1 kg 2
8b534445-cfb2-40ad-b30d-e1110a13154c Environmental → Water → Long-term EF 3.1 kg 0
5faf7405-fc7e-4d49-819e-8f812afee555 Environmental → Water → Ocean EF 3.1 kg 2
45fe0092-ade8-43cb-bf47-f33abddff2e7 Environmental → Water → Surface water EF 3.1 kg 2
5155a01e-3f14-4a91-895b-05f403104164 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 
{
  "flow_object_id": "fo-c1fc96fabd9af414",
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      "@value": "Ferrate(2-), [[n,n'-1,2-ethanediylbis[n-[(carboxy-ko)methyl]glycinato-kn,ko]](4-)]hydroxy-, Ammonium (1:2), (pb-7-11'-121'3'3)",
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  ],
  "altLabel": [
    {
      "@value": "Ferrate(2-), [[N,N′-1,2-ethanediylbis[N-(carboxymethyl)glycinato]](4-)-N,N′,O,O′,ON,ON′]hydroxy-, diammonium, (PB-7-11′-121′3′3)-",
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      "@value": "Ferrate(2-), [[N,N′-1,2-ethanediylbis[N-[(carboxy-κO)methyl]glycinato-κN,κO]](4-)]hydroxy-, ammonium (1:2), (PB-7-11′-121′3′3)-",
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}

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