Consensus flow list

Identity

Type
Neutral molecule
CAS
999-61-1
EC
213-663-8
Origin
EF 3.1 hybrid_name_cas_v1
Changes
55 across every transformer

Structure

Structure diagram for 2-hydroxypropyl Acrylate

Alternative labels

13

Properties

PropertyValue
InChI2D key string chemrof:inchi2d_key_string GWZMWHWAWHPNHN-UHFFFAOYSA-N
InChI2D string chemrof:inchi2d_string InChI=1S/C6H10O3/c1-3-6(8)9-4-5(2)7/h3,5,7H,1,4H2,2H3
IUPAC name chemrof:IUPAC_name 2-hydroxypropyl Acrylate
Molecular formula chemrof:molecular_formula C6H10O3
Molecular mass chemrof:molecular_mass 130.143
Monoisotopic mass chemrof:monoisotopic_mass 130.062994
SMILES string chemrof:smiles_string C=CC(=O)OCC(C)O

Known URLs

12

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=32029-53-1 enrich_references.pubchem_identifier_url
CAS Common Chemistry https://commonchemistry.cas.org/detail?cas_rn=999-61-1 enrich_references.consensus_cas_link
cdc.gov https://www.cdc.gov/niosh-rtecs/AT1D5F88.html enrich_references.pubchem_identifier_url
chem.echa.europa.eu https://chem.echa.europa.eu/100.012.421 enrich_references.pubchem_identifier_url
chemicalsafety.ilo.org https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0899 enrich_references.pubchem_identifier_url
comptox.epa.gov https://comptox.epa.gov/dashboard/DTXSID0022143 enrich_references.pubchem_identifier_url
ebi.ac.uk https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3184912 enrich_references.pubchem_identifier_url
gsrs.ncats.nih.gov https://gsrs.ncats.nih.gov/ginas/app/beta/substances/F17T4R74K6 enrich_references.pubchem_identifier_url
jglobal.jst.go.jp http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J33.773K enrich_references.pubchem_identifier_url
PubChem https://pubchem.ncbi.nlm.nih.gov/compound/61249 enrich_references.pubchem_compound
PubChem https://pubchem.ncbi.nlm.nih.gov/erg/#2927 enrich_references.pubchem_identifier_url
wikidata.org https://www.wikidata.org/wiki/Q2238032 enrich_references.pubchem_identifier_url

Elementary flows

13
Flow Context Source Unit CFs
1591f915-cc0b-465d-8ffe-ba447caf1fa9 Environmental → Air → Aircraft cruise height EF 3.1 kg 2
e95d6592-bc83-4911-91a3-66264adacf80 Environmental → Air → Ground level → Urban (>1000 people/square mile) EF 3.1 kg 2
fbaf0f75-fd97-4333-900f-dae088cdfa7f Environmental → Air → Indoor EF 3.1 kg 2
c94a9225-572e-4186-8424-43a712d8946c Environmental → Air → Long-term EF 3.1 kg 0
d331208a-9857-4b7b-899e-91e9860b188b Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) EF 3.1 kg 2
72c549b7-7e48-41e5-b835-e5c399f29704 Environmental → Air → Unknown EF 3.1 kg 2
71cb462f-bd37-4f39-8975-8fd65e368368 Environmental → Ground → Agricultural EF 3.1 kg 2
6cddf3ad-71f9-459c-b71d-61790ac7c141 Environmental → Ground → Non-agricultural EF 3.1 kg 2
201a2b3a-c3c1-4ca1-972d-bdcb34c79aba Environmental → Ground → Unknown EF 3.1 kg 2
e0c9d665-0b62-4fdd-88ce-6bb93fdd3650 Environmental → Water → Long-term EF 3.1 kg 0
2dfd6214-0e2f-4c62-a0fa-5d30602642dc Environmental → Water → Ocean EF 3.1 kg 2
537389db-e8b6-4c5e-89ac-f8ad2360260f Environmental → Water → Surface water EF 3.1 kg 2
525cc13c-92bb-4155-9864-65666049bbef Environmental → Water → Unknown EF 3.1 kg 2

History

Everything that changed this substance (55 changes)

Open the changes page

Full record

Flow object JSON
{
  "flow_object_id": "fo-e2716afaae68d320",
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    {
      "@value": "2-hydroxypropyl Acrylate",
      "@language": "en",
      "@lang": "en",
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  ],
  "altLabel": [
    {
      "@value": "1,2-Propanediol, 1-acrylate",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Hydroxy-2-methylethyl acrylate",
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        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "2-Hydroxypropyl pro-2-enoate",
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    },
    {
      "@value": "2-Propenoic acid, 2-hydroxypropyl ester",
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    },
    {
      "@value": "Acrylic acid, 2-hydroxypropyl ester",
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    {
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  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "999-61-1"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=999-61-1"
      ],
      "http://www.w3.org/2004/02/skos/core#exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=999-61-1"
        }
      ],
      "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": [
        "213-663-8"
      ],
      "rdfs:seeAlso": [
        "https://echa.europa.eu/search-for-chemicals?query=213-663-8"
      ],
      "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/NeutralMolecule"
  ]
}

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