Consensus flow list

Identity

Type
NeutralMolecule
CAS
29911-27-1
EC
249-949-4
Origin
EF 3.1 hybrid_name_cas_v1
Changes
54 across every transformer

Structure

Structure diagram for 1-(1-methyl-2-propoxyethoxy)propan-2-ol

Alternative labels

8

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string WEZPLQKRXDBPEP-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C9H20O3/c1-4-5-11-7-9(3)12-6-8(2)10/h8-10H,4-7H2,1-3H3
IUPAC name chemrof:IUPAC_name 1-(1-methyl-2-propoxyethoxy)propan-2-ol
Molecular formula chemrof:molecular_formula C9H20O3
Molecular mass chemrof:molecular_mass 176.256
Monoisotopic mass chemrof:monoisotopic_mass 176.141244
SMILES string chemrof:smiles_string CCCOCC(C)OCC(C)O

Known URLs

8

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=29911-27-1 enrich_references.consensus_cas_link
chem.echa.europa.eu https://chem.echa.europa.eu/100.045.394 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID3033276 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1392153 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/9KVZ6BMU0K enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J25.047C enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/121752 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q27272686 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
476738e0-5884-42c6-9123-3d76a23a8ede Environmental → Air → Aircraft cruise height EF 3.1 kg 4
f36ea44d-e0f0-46ef-af28-dfc1dfade34e Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 4
e497ee75-32a5-4b0f-af34-31de2c57bd7f Environmental → Air → Indoor EF 3.1 kg 4
c420c28c-a4df-4e49-84ab-57d16e506d84 Environmental → Air → Long-term EF 3.1 kg 0
e646f95b-e0e9-4e0e-8a0e-a3b33f7ff08f Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 4
9fdd4697-7613-4c7d-a5a5-6f8d754ef24b Environmental → Air → Unknown EF 3.1 kg 4
6b54a0da-022d-44da-ac6a-1511faa3dd60 Environmental → Ground → Agricultural EF 3.1 kg 4
7c16a888-9e14-4752-ba60-585cb6740df7 Environmental → Ground → Non-agricultural EF 3.1 kg 4
b004b0b4-d070-4670-b5a3-67cf3b9ba2b6 Environmental → Ground → Unknown EF 3.1 kg 4
ca7a95d2-bdc8-40ef-a400-de5cc3ca38b9 Environmental → Water → Long-term EF 3.1 kg 0
b60e7909-9bfb-4b0f-afb5-cdee9abd58c8 Environmental → Water → Ocean EF 3.1 kg 4
8346e0c3-3009-4c1c-9d39-d4eb90d041bd Environmental → Water → Surface water EF 3.1 kg 4
fe250d3c-fe40-4f0d-8c2b-3811ff43c037 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-960c880082ec88da",
  "prefLabel": [
    {
      "@value": "1-(1-methyl-2-propoxyethoxy)propan-2-ol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "1-(1-Methyl-2-propoxyethoxy)-2-propanol",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=29911-27-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Propanol, 1-(1-methyl-2-propoxyethoxy)-",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Arcosolv DPNP",
      "@language": "en",
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        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Celtol DPNP",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
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      "@language": "en",
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        ],
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      }
    },
    {
      "@value": "Dipropylene glycol, monopropyl ether",
      "@language": "en",
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      }
    },
    {
      "@value": "Dipropylene glycol, propyl ether",
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      }
    },
    {
      "@value": "Dowanol DPnP",
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    },
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  "references": [
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}

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