Consensus flow list

Identity

Type
Chemical salt
CAS
555-31-7
EC
209-090-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Aluminum Tripropan-2-olate

Alternative labels

31

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string SMZOGRDCAXLAAR-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/3C3H7O.Al/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3
IUPAC name chemrof:IUPAC_name Aluminum Tripropan-2-olate
Molecular formula chemrof:molecular_formula C9H21AlO3
Molecular mass chemrof:molecular_mass 204.246, 87.078
Monoisotopic mass chemrof:monoisotopic_mass 204.130608, 87.039054
SMILES string chemrof:smiles_string CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]

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=555-31-7 enrich_references.pubchem_identifier_url
dtp.cancer.gov https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=7604 enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/45051571 enrich_references.pubchem_compound

Elementary flows

13
Flow Context Source Unit CFs
6df5ac39-6a87-486d-ae23-1e03011f7884 Environmental → Air → Aircraft cruise height EF 3.1 kg 4
31f7896a-a456-4081-92a5-58378e615444 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
5c7816ee-b241-46d3-92ac-91e23ed04bfe Environmental → Air → Indoor EF 3.1 kg 4
acdf6f6c-753d-42fb-9800-e58601b475be Environmental → Air → Long-term EF 3.1 kg 0
076663fc-2e04-4e51-ab6c-b5a8930f8753 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
8f24eb48-2f6c-4283-9e1f-b7d58bf3578d Environmental → Air → Unknown EF 3.1 kg 4
eca61686-9bd7-46b9-a53b-631a5a7783f2 Environmental → Ground → Agricultural EF 3.1 kg 4
02c86bdd-0dec-4221-9022-ea511a361adf Environmental → Ground → Non-agricultural EF 3.1 kg 4
41a7fef9-5a57-4801-a6d1-7e39f19fd666 Environmental → Ground → Unknown EF 3.1 kg 4
c235cd05-5b72-469b-a1cd-13f7b2d469c6 Environmental → Water → Long-term EF 3.1 kg 0
40aae282-be33-4e99-b599-77aeedb7b812 Environmental → Water → Ocean EF 3.1 kg 4
2f3c7b3e-2ee2-4886-920e-7dc5000ce98d Environmental → Water → Surface water EF 3.1 kg 4
edc8aa7d-7101-4f52-b8a8-82f3bebb8604 Environmental → Water → Unknown EF 3.1 kg 4

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-8e85bdaf0af99f56",
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  ],
  "altLabel": [
    {
      "@value": "2-Propanol, aluminum salt",
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    {
      "@value": "2-Propanol, aluminum salt (3:1)",
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    {
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    {
      "@value": "Aliso",
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    {
      "@value": "Aluminium isopropoxide",
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    {
      "@value": "Aluminium trisopropoxide",
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    {
      "@value": "Aluminum 2-propoxide",
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    },
    {
      "@value": "Aluminum isopropanolate",
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        ],
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      }
    },
    {
      "@value": "Aluminum isopropioate",
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    },
    {
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    },
    {
      "@value": "Aluminum isopropoxide (1:3)",
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    {
      "@value": "Aluminum isopropylate",
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    {
      "@value": "Aluminum isopropylate (Al(OC3H7)3)",
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        ],
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      }
    },
    {
      "@value": "Aluminum sec-propanolate",
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        ],
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      }
    },
    {
      "@value": "Aluminum triisopropoxide",
      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Aluminum triisopropylate",
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        ],
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      }
    },
    {
      "@value": "Aluminum tris(iso-propoxide)",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Aluminum tris(isopropoxide)",
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        ],
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      }
    },
    {
      "@value": "Aluminum tris(isopropylate)",
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    },
    {
      "@value": "Aluminum tris(sec-propoxide)",
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    },
    {
      "@value": "Aluminum(3+) isopropoxide",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropanol aluminum salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropyl alcohol, aluminum salt",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "PADM",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=555-31-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "SYM-AL 04",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=555-31-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triisopropoxyaluminum",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=555-31-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triisopropyl aluminate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=555-31-7"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Triisopropyloxyaluminum",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Tris(isopropanolato)aluminum",
      "@language": "en",
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      "provenance": {
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Tris(isopropoxide)aluminum",
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        ],
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      }
    },
    {
      "@value": "Tris(isopropoxy)aluminum",
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      "provenance": {
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  ],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C9H21AlO3"
      ],
      "attested_by": {
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    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "SMZOGRDCAXLAAR-UHFFFAOYSA-N"
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    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "rdfs:label": "SMILES",
      "@value": [
        "CC(C)[O-].CC(C)[O-].CC(C)[O-].[Al+3]"
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      "provenance": [
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
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      "rdfs:label": "InChI",
      "@value": [
        "InChI=1S/3C3H7O.Al/c3*1-3(2)4;/h3*3H,1-2H3;/q3*-1;+3"
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      "attested_by": {
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    },
    "https://w3id.org/chemrof/molecular_mass": {
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      "rdfs:label": "Molecular mass",
      "@value": [
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}

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