Consensus flow list

Identity

Type
Molecular complex
CAS
85209-93-4
EC
458-880-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for Lithium 2,2'-methylenebis(4,6-di-tert-butylphenyl)phosphate

Alternative labels

5

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string NNRDUKDZCKKLLN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C29H43O4P.Li/c1-26(2,3)20-14-18-13-19-15-21(27(4,5)6)17-23(29(10,11)12)25(19)33-34(30,31)32-24(18)22(16-20)28(7,8)9;/h14-17H,13H2,1-12H3,(H,30,31);
Molecular formula chemrof:molecular_formula C29H43LiO4P
Molecular mass chemrof:molecular_mass 493.574
Monoisotopic mass chemrof:monoisotopic_mass 493.305901
SMILES string chemrof:smiles_string [Li].CC(C)(C)C1=CC2=C(C(=C1)C(C)(C)C)OP(=O)(OC3=C(C2)C=C(C=C3C(C)(C)C)C(C)(C)C)O

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=85209-93-4 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/131885935 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q126674215 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
f86b9a26-15cc-4392-93db-bcff7a39aeff Environmental → Air → Aircraft cruise height EF 3.1 kg 4
66fe1676-05e8-473e-9503-49482463a1ed Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
a49909e4-2f24-4af5-909c-55686368b0c4 Environmental → Air → Indoor EF 3.1 kg 4
90e6c017-07d7-44d7-9d5a-fff9f2793af3 Environmental → Air → Long-term EF 3.1 kg 0
aa83630c-d383-4764-9de6-0111caa87778 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
7a6baa22-7f4e-4000-8586-871f7396addf Environmental → Air → Unknown EF 3.1 kg 4
6f10c397-5d20-442f-9ab7-dfddcc384414 Environmental → Ground → Agricultural EF 3.1 kg 4
20ac9247-727b-4d3a-bb03-43e562181642 Environmental → Ground → Non-agricultural EF 3.1 kg 4
5476d8df-73c6-4a1e-9771-50e04363133c Environmental → Ground → Unknown EF 3.1 kg 4
e2925056-31f7-4235-b9c1-bdf0b84a69a3 Environmental → Water → Long-term EF 3.1 kg 0
270d50fd-cdb8-42ae-90fc-1c89d618f77a Environmental → Water → Ocean EF 3.1 kg 4
15ce4bc1-5f55-432e-a528-f08fb71b61a6 Environmental → Water → Surface water EF 3.1 kg 4
2326f6d7-aa57-4dc1-aca0-c5f70738bfc8 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-ad3503cc6ed5b308",
  "prefLabel": [
    {
      "@value": "Lithium 2,2'-methylenebis(4,6-di-tert-butylphenyl)phosphate",
      "@language": "en",
      "@lang": "en",
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      }
    }
  ],
  "altLabel": [
    {
      "@value": "12H-Dibenzo[d,g][1,3,2]dioxaphosphocin, 2,4,8,10-tetrakis(1,1-dimethylethyl)-6-hydroxy-, 6-oxide, lithium salt",
      "@language": "en",
      "@lang": "en",
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        ],
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    },
    {
      "@value": "12H-Dibenzo[d,g][1,3,2]dioxaphosphocin, 2,4,8,10-tetrakis(1,1-dimethylethyl)-6-hydroxy-, 6-oxide, lithium salt (1:1)",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2′-Methylenebis(4,6-di-tert-butylphenol) phosphate lithium salt",
      "@language": "en",
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    },
    {
      "@value": "ADK Stab NA 71",
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C29H43O4P.Li/c1-26(2,3)20-14-18-13-19-15-21(27(4,5)6)17-23(29(10,11)12)25(19)33-34(30,31)32-24(18)22(16-20)28(7,8)9;/h14-17H,13H2,1-12H3,(H,30,31);"
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    },
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}

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