Consensus flow list

Identity

Type
Chemical salt
CAS
22464-99-9
EC
245-018-1
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2-ethylhexanoic Acid, Zirconium Salt

Alternative labels

6

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string NKWYNUVSOUOQRV-UHFFFAOYSA-N, OFYFURKXMHQOGG-UHFFFAOYSA-J, QOGWLMJSBXSOMN-UHFFFAOYSA-N, RIYRDRZNXDRTIL-BGEHQDIKSA-L, XVKFNYWCEGQKPN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/4C8H16O2.Zr/c4*1-3-5-6-7(4-2)8(9)10;/h4*7H,3-6H2,1-2H3,(H,9,10);/q;;;;+4/p-4
IUPAC name chemrof:IUPAC_name 2-ethylhexanoic Acid, Zirconium Salt
Molecular formula chemrof:molecular_formula C16H30O4Zr, C32H60O8Zr, C32H64O8Zr, C8H16O2Zr+4
SMILES string chemrof:smiles_string CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zr+4]

Known URLs

6

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=22464-99-9 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.040.910 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/11125210 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/112500423 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/13366094 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/170923288 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
e0d70af7-ff40-44af-89c2-cc35500090d1 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
9c1c48d7-4b66-4f41-8f76-77e829e32bae Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
4cb5ef05-8d81-4292-977c-d6ae98fe8df8 Environmental → Air → Indoor EF 3.1 kg 4
14ede71a-261b-4612-9d9b-9f1879c003d3 Environmental → Air → Long-term EF 3.1 kg 0
25fb5026-ada8-4b93-8b5d-99ada0fdb20f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
0291b58b-1df5-47dc-a14a-8a24c910da82 Environmental → Air → Unknown EF 3.1 kg 4
6b611948-19e6-4df1-b347-b34a848baffc Environmental → Ground → Agricultural EF 3.1 kg 4
29763228-b70a-4ffe-b4a4-a4835c6efef7 Environmental → Ground → Non-agricultural EF 3.1 kg 4
cb25dd80-4676-4900-ae0f-4a78ebac761c Environmental → Ground → Unknown EF 3.1 kg 4
58ea6536-9c5f-4218-936b-095c0a0376e3 Environmental → Water → Long-term EF 3.1 kg 0
5fb2c1f6-e71c-4329-ac91-72fcba25bdc6 Environmental → Water → Ocean EF 3.1 kg 4
abb430fe-c297-4f12-bfd5-63160931aa1e Environmental → Water → Surface water EF 3.1 kg 4
9dd7666e-1957-4a82-939a-aba867f00b4a Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-aa9749f56f710b85",
  "prefLabel": [
    {
      "@value": "2-ethylhexanoic Acid, Zirconium Salt",
      "@language": "en",
      "@lang": "en",
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          "EF 3.1"
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        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "Hexanoic acid, 2-ethyl-, zirconium salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hexanoic acid, 2-ethyl-, zirconium salt (1:?)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Octa-Soligen Zirconium 10",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
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      }
    },
    {
      "@value": "Octope Zr",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Zirconium 2-ethylhexanoate",
      "@language": "en",
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    },
    {
      "@value": "Zirconium Hex-Cem",
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}

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