Consensus flow list

Identity

Type
Molecular complex
CAS
3290-92-4
EC
221-950-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
59 across every transformer

Structure

Structure diagram for Trimethylolpropane trimethacrylate

Alternative labels

51

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string OKKRPWIIYQTPQF-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H14O3.3C4H6O2/c1-2-6(3-7,4-8)5-9;3*1-3(2)4(5)6/h7-9H,2-5H2,1H3;3*1H2,2H3,(H,5,6)
IUPAC name chemrof:IUPAC_name Trimethylolpropane trimethacrylate
Molecular formula chemrof:molecular_formula C18H26O6
Molecular mass chemrof:molecular_mass 338.4
Monoisotopic mass chemrof:monoisotopic_mass 338.172939, 338.17294
SMILES string chemrof:smiles_string C=C(C)C(=O)O.C=C(C)C(=O)O.C=C(C)C(=O)O.CCC(CO)(CO)CO

Known URLs

13

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=26426-04-0 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=3290-92-4 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:35029 enrich_references.chebi_id_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.019.956 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3027530 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=84261 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1901244 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/S734UC120F enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J64.284C enrich_references.pubchem_identifier_url
KEGG https://www.genome.jp/entry/C14538 enrich_references.chebi_xrefs
kegg.jp https://www.kegg.jp/entry/C14538 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/18689 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27116373 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
2277bf71-dfbe-4d3e-a9e5-4205fbace337 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
530598f6-c283-4db1-be71-e55ee0eb8345 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
a739c307-8ee0-4034-9b73-068e98e353b9 Environmental → Air → Indoor EF 3.1 kg 2
288736a9-a674-4272-9f5e-8a770eecccc5 Environmental → Air → Long-term EF 3.1 kg 0
8deff079-14ad-4776-88b2-efd8a6d0ee14 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
ef4d62f5-9ae3-4934-a8fb-3259d76a5e52 Environmental → Air → Unknown EF 3.1 kg 2
36efad85-4c03-4647-aa2e-fd46cbe99b10 Environmental → Ground → Agricultural EF 3.1 kg 2
d11e3647-937a-4d45-8030-cbe906ffa182 Environmental → Ground → Non-agricultural EF 3.1 kg 2
b422055e-0964-44c6-808c-d441ecbf529d Environmental → Ground → Unknown EF 3.1 kg 2
eae328b9-1fd2-450e-91e6-875a3fe32af4 Environmental → Water → Long-term EF 3.1 kg 0
7f5399be-c67e-4cbe-ae8c-d2e6221e5142 Environmental → Water → Ocean EF 3.1 kg 2
f34b075c-494c-45bb-9514-4b98303f26df Environmental → Water → Surface water EF 3.1 kg 2
ec34a2e3-4a25-4406-be6e-3ef633553228 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (59 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-c921d7b80855c56e",
  "prefLabel": [
    {
      "@value": "Trimethylolpropane trimethacrylate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:hadPrimarySource": [
          "CAS:3290-92-4",
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "Common Chemistry / ChEBI primary name agreement"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1,1,1-Trimethylolpropane trimethacrylate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "1,1,1-Tris(hydroxymethyl)propane trimethacrylate",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2-Bis(2-methylprop-2-enoyloxymethyl)butyl 2-methylprop-2-enoate",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2,2-bis[(methacryloyloxy)methyl]butyl Methacrylate (non-preferred Name)",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasDerivedFrom": "original name retained as altLabel"
      }
    },
    {
      "@value": "2-Ethyl-2(hydroxymethyl)-1,3-propanediol trimethacrylate",
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        "prov:wasDerivedFrom": "chebi synonym match"
      }
    },
    {
      "@value": "2-Ethyl-2-(hydroxymethyl)-1,3-propanediol trimethacrylate",
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      }
    },
    {
      "@value": "2-Propenoic acid, 2-methyl-, 1,1′-[2-ethyl-2-[[(2-methyl-1-oxo-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester",
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      }
    },
    {
      "@value": "2-Propenoic acid, 2-methyl-, 2-ethyl-2-[[(2-methyl-1-oxo-2-propenyl)oxy]methyl]-1,3-propanediyl ester",
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    },
    {
      "@value": "Acryester TMP",
      "@language": "en",
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    },
    {
      "@value": "Actigran 70",
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      }
    },
    {
      "@value": "Actigran SO 70",
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      }
    },
    {
      "@value": "Alcanpoudre TMPTMA 70",
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      }
    },
    {
      "@value": "Bisomer TMPTMA",
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      }
    },
    {
      "@value": "Blemmer PTT",
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        ],
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      }
    },
    {
      "@value": "Chemlink 30",
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        ],
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      }
    },
    {
      "@value": "Hi-Cross M",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Hi-Cross M-P",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Hi-Cross MS 50",
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        ],
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      }
    },
    {
      "@value": "Laromer TMPTMA",
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      }
    },
    {
      "@value": "Light Ester TMP",
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        ],
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      }
    },
    {
      "@value": "Lumicure TMM 300",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Luvomaxx TMPT-DL 75",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Methacrylic acid, triester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Miramer M 301",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Monocizer TD 1500",
      "@language": "en",
      "@lang": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Newfrontier NF Bisomer TMPTMA",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Newfrontier TMPTM",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "NF Bisomer TMPTMA",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "NK Ester M-TMPT",
      "@language": "en",
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      }
    },
    {
      "@value": "NK Ester TMPT",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Nourycryl M 36",
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    },
    {
      "@value": "Ogmont T 200",
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    },
    {
      "@value": "Ogumont T 200",
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    },
    {
      "@value": "Ogumont T 200/01",
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      }
    },
    {
      "@value": "Perkalink 400-50D",
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      }
    },
    {
      "@value": "PL 400-70D",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "PTMA",
      "@language": "en",
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      "provenance": {
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        }
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "cas_numbers"
      }
    },
    "http://semanticscience.org/resource/CHEMINF_000447": {
      "@value": [
        "221-950-4"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=221-950-4"
      ],
      "provenance": {
        "prov:wasGeneratedBy": "hybrid_name_cas_v1",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "ec_numbers"
      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null,
  "parent_intervention_id": null,
  "@type": [
    "https://w3id.org/chemrof/MolecularComplex"
  ]
}

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