Consensus flow list

Identity

Type
Neutral molecule
CAS
617-51-6
EC
210-518-0
Origin
EF 3.1 hybrid_name_cas_v1
Changes
56 across every transformer

Structure

Structure diagram for Isopropyl Lactate

Alternative labels

7

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string KIWATKANDHUUOB-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H12O3/c1-4(2)9-6(8)5(3)7/h4-5,7H,1-3H3
IUPAC name chemrof:IUPAC_name Isopropyl Lactate
Molecular formula chemrof:molecular_formula C6H12O3
Molecular mass chemrof:molecular_mass 132.159
Monoisotopic mass chemrof:monoisotopic_mass 132.078644
SMILES string chemrof:smiles_string CC(C)OC(=O)C(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=157865-02-6 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=193553-89-8 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=617-51-6 enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.009.563 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID70858732 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J135.613E enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/61160 enrich_references.pubchem_compound
wikidata.org https://www.wikidata.org/wiki/Q81986159 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
b2ef6c0e-fda7-4996-93d1-76d6214631fd Environmental → Air → Aircraft cruise height EF 3.1 kg 2
6928c45d-bc0b-44fa-892d-2b24d42420c3 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
6362167f-cdd2-4ebf-a9bd-ce6970490f8c Environmental → Air → Indoor EF 3.1 kg 2
ebf6c18d-4578-4061-ba7d-55b25f90715f Environmental → Air → Long-term EF 3.1 kg 0
2ddc2013-5bb8-45b8-967a-d445f8afcd85 Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
5f8b75bf-238c-467b-b31e-54d649bf1c60 Environmental → Air → Unknown EF 3.1 kg 2
562b0ef5-6c06-46ff-9826-1450f4fdefc5 Environmental → Ground → Agricultural EF 3.1 kg 2
b2d87a39-24a2-407e-ad01-fe3371192d23 Environmental → Ground → Non-agricultural EF 3.1 kg 2
c0006e0e-1ecb-4136-b174-8612f24fadc9 Environmental → Ground → Unknown EF 3.1 kg 2
138dbcac-3190-4478-9f93-c6ed008af216 Environmental → Water → Long-term EF 3.1 kg 0
d0de6f81-199e-4da0-b618-f2b79e026d13 Environmental → Water → Ocean EF 3.1 kg 2
7bc23e92-2fe0-4339-86a1-71c546f731d5 Environmental → Water → Surface water EF 3.1 kg 2
e7b86aa8-8437-43e8-b677-7b2b5eb13b82 Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (56 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-0fae60d9601904d5",
  "prefLabel": [
    {
      "@value": "Isopropyl Lactate",
      "@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": "(±)-Isopropyl lactate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
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          "https://commonchemistry.cas.org/detail?cas_rn=617-51-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "DL-Isopropyl lactate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:617-51-6",
          "EF 3.1",
          "https://commonchemistry.cas.org/detail?cas_rn=617-51-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropyl 2-hydroxypropanoate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=617-51-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Isopropyl DL-lactate",
      "@language": "en",
      "@lang": "en",
      "provenance": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
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          "https://commonchemistry.cas.org/detail?cas_rn=617-51-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Lactic acid, isopropyl ester",
      "@language": "en",
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      "provenance": {
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          "https://commonchemistry.cas.org/detail?cas_rn=617-51-6"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Propanoic acid, 2-hydroxy-, 1-methylethyl ester",
      "@language": "en",
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      "provenance": {
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        ],
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      }
    },
    {
      "@value": "Purasolv IPL",
      "@language": "en",
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    },
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    },
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      "provenance": {
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      ],
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      },
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    },
    "https://w3id.org/chemrof/monoisotopic_mass": {
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}

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