Consensus flow list

Identity

Type
Neutral molecule
CAS
10191-41-0
EC
233-466-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol

Alternative labels

23

Properties

PropertyValue
Elemental charge chemrof:elemental_charge 0
InChI2D key string chemrof:inchi2d_key_string GVJHHUAWPYXKBD-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3
IUPAC name chemrof:IUPAC_name 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)chroman-6-ol
Molecular formula chemrof:molecular_formula C29H50O2
Molecular mass chemrof:molecular_mass 430.707, 430.717
Monoisotopic mass chemrof:monoisotopic_mass 430.38108, 430.381081
SMILES string chemrof:smiles_string Cc1c(C)c2c(c(C)c1O)CCC(C)(CCCC(C)CCCC(C)CCCC(C)C)O2

Known URLs

7

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
beilstein beilstein:8176170 enrich_references.chebi_xrefs
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=10191-41-0 enrich_references.chebi_xrefs
ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:22470 enrich_references.chebi_id_link
KEGG https://www.genome.jp/entry/D02332 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/23949732 enrich_references.chebi_xrefs
PubMed https://pubmed.ncbi.nlm.nih.gov/24683365 enrich_references.chebi_xrefs
Wikipedia https://en.wikipedia.org/wiki/Alpha-Tocopherol enrich_references.chebi_xrefs

Elementary flows

13
Flow Context Source Unit CFs
1cb7e797-8a85-4137-8644-c366ca321689 Environmental → Air → Aircraft cruise height EF 3.1 kg 0
89e31816-dae8-4234-9568-1f2b2f500c23 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 0
bb3716e8-857d-4697-8b84-bd35911b7cc5 Environmental → Air → Indoor EF 3.1 kg 0
2db98f9f-b26f-47f6-936a-5feed16fd698 Environmental → Air → Long-term EF 3.1 kg 0
9140cf8a-5374-4d43-a6a3-c845b4551dcc Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 0
4557b767-29ea-4673-8f3b-896da5c8cace Environmental → Air → Unknown EF 3.1 kg 0
19d227db-707b-4f69-b6cd-541c80da84bf Environmental → Ground → Agricultural EF 3.1 kg 0
1060279d-e453-4cb3-a581-9f9c3d4d3aef Environmental → Ground → Non-agricultural EF 3.1 kg 0
d8bc7ad2-56b5-4f88-a771-2e54c4fcd252 Environmental → Ground → Unknown EF 3.1 kg 0
2be231b8-5fec-488b-aa1b-a1cc0fbc7e7f Environmental → Water → Long-term EF 3.1 kg 0
c3e9c32a-5b29-49e5-a016-0c088c221de5 Environmental → Water → Ocean EF 3.1 kg 0
6cc97a93-f793-460e-938d-6ea6fea215de Environmental → Water → Surface water EF 3.1 kg 0
8c81dea4-c0be-4059-9017-ffe25304a076 Environmental → Water → Unknown EF 3.1 kg 0

History

Everything that changed this substance (54 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-52a800f04d910c96",
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    {
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    },
    {
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    },
    {
      "@value": "2,5,7,8-Tetramethyl-2-(4′,8′,12′-trimethyltridecyl)chroman-6-ol",
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    },
    {
      "@value": "2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-",
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    },
    {
      "@value": "6-Chromanol, 2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-",
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    {
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    },
    {
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    {
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    },
    {
      "@value": "E307",
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    {
      "@value": "Elementol B",
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    },
    {
      "@value": "Elementol Basic",
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    },
    {
      "@value": "Elementol R",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Ephanyl",
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        ],
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      }
    },
    {
      "@value": "Irganox E 210",
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    },
    {
      "@value": "Irganox LE 307",
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    {
      "@value": "Rac-α-Tocopherol",
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    },
    {
      "@value": "rel-(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydro-2H-chromen-6-ol",
      "@language": "en",
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    },
    {
      "@value": "Ronotec DF 120",
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    },
    {
      "@value": "Uvinul 2000AO",
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
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        "C29H50O2"
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    },
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      "rdfs:label": "SMILES",
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    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
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}

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