← Back to consensus flows

3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyl Dodecanoate/n

UUID 15c6a403-1985-4266-a78e-9346d5ba7989
Deprecated yes
Replaced By 944d4d0a-cced-4c6f-a03e-00e2ab22ffb6
Flow Object IDfo-71842226a4761fd1
Source EF 3.1
Context Environmental → Water → Unknown
CAS Numbers 931419-77-1
EC Numbers 700-067-2
prefLabel
Language Value Provenance
en 3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyl Dodecanoate/n
altLabel ⓘ
Language Value Provenance
en 3-[[2-(2-Hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl dodecanoate
en Dodecanoic acid, 3-[[2-(2-hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl ester
References
Shared Properties
Predicate Value
InChIKey OIOXSPCSRJPJNN-UHFFFAOYSA-N
InChI InChI=1S/C21H41NO4/c1-4-5-6-7-8-9-10-11-12-13-20(24)26-19-21(2,3)18-22-14-16-25-17-15-23/h18,23H,4-17,19H2,1-3H3
IUPAC name [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethyl-propyl] dodecanoate, [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethylpropyl] dodecanoate, [3-[2-(2-hydroxyethyloxy)ethylimino]-2,2-dimethyl-propyl] dodecanoate, dodecanoic acid [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethylpropyl] ester, lauric acid [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethyl-propyl] ester
Molecular formula C21H41NO4
SMILES CCCCCCCCCCCC(=O)OCC(C)(C)C=NCCOCCO

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 15c6a403-1985-4266-a78e-9346d5ba7989 3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyl dodecanoate/n

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 — consensus_match group_key=3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyldodecanoate/n||dimension=Environmental > media=Ground > geography=Unknown; cas=931419-77-1; added Common Chemistry CAS names as altLabel: 3-[[2-(2-Hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl dodecanoate, Dodecanoic acid, 3-[[2-(2-hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl ester; object_uuid=fo-71842226a4761fd1
cas_match_labels 1 — consensus_match group_key=3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyldodecanoate/n||dimension=Environmental > media=Ground > geography=Unknown; group_sources=[]; cas_sources={'931419-77-1': []}; assigned CAS labels from group consensus; object_uuid=fo-71842226a4761fd1: {'931419-77-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodyUnknown

Consensus Changes

Field Old Value New Value Comment
altLabel None [{'@value': '3-[[2-(2-Hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl dodecanoate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:931419-77-1', 'https://commonchemistry.cas.org/detail?cas_rn=931419-77-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Dodecanoic acid, 3-[[2-(2-hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl ester', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:931419-77-1', 'https://commonchemistry.cas.org/detail?cas_rn=931419-77-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyldodecanoate/n||dimension=Environmental > media=Ground > geography=Unknown; cas=931419-77-1; added Common Chemistry CAS names as altLabel: 3-[[2-(2-Hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl dodecanoate, Dodecanoic acid, 3-[[2-(2-hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl ester; object_uuid=fo-71842226a4761fd1
cas_match_labels None {'931419-77-1': 'exactMatch'} group_key=3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyldodecanoate/n||dimension=Environmental > media=Ground > geography=Unknown; group_sources=[]; cas_sources={'931419-77-1': []}; assigned CAS labels from group consensus; object_uuid=fo-71842226a4761fd1: {'931419-77-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
  "uuid": "15c6a403-1985-4266-a78e-9346d5ba7989",
  "name": null,
  "cas_numbers": [
    "931419-77-1"
  ],
  "ec_numbers": [
    "700-067-2"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Water",
    "water_body": "Unknown"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [],
  "source": "EF 3.1",
  "identifier": "15c6a403-1985-4266-a78e-9346d5ba7989",
  "input_datasets": [
    "EF 3.1"
  ],
  "source_refs": [
    {
      "list_name": "EF",
      "list_version": "3.1",
      "source_flow_uuid": "15c6a403-1985-4266-a78e-9346d5ba7989",
      "source_flow_name": "3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyl dodecanoate/n",
      "source_metadata": {
        "input_file": "/home/cmutel/.local/share/consensus-flow-list/ef-31-flows.json",
        "input_dataset": "EF 3.1",
        "original_context": [
          "Emissions",
          "Emissions to water",
          "Emissions to water, unspecified (long-term)"
        ]
      }
    }
  ],
  "prefLabel": [
    {
      "@value": "3-(2-(2-hydroxyethoxy)ethylimino)-2,2-dimethylpropyl Dodecanoate/n",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "bootstrap_labels",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "legacy name field"
      }
    }
  ],
  "_sources": {
    "prefLabel": "normalize_name_case",
    "name": "bootstrap_labels",
    "synonyms": "bootstrap_labels",
    "context": "default_context_mapping",
    "context_iri": "default_context_mapping",
    "unit_iri": "unit_normalization",
    "properties": "enrich_references",
    "skos:definition": "enrich_references",
    "references": "enrich_references",
    "altLabel": "consensus_match",
    "cas_match_labels": "consensus_match"
  },
  "context_iri": "https://vocab.brightway.one/flow-contexts/envi-wate-unkn",
  "unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
  "properties": {
    "https://w3id.org/chemrof/molecular_formula": {
      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C21H41NO4"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478"
        ],
        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_key_string",
      "@value": [
        "OIOXSPCSRJPJNN-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CCCCCCCCCCCC(=O)OCC(C)(C)C=NCCOCCO"
      ],
      "rdfs:label": "SMILES",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478"
        ],
        "prov:wasDerivedFrom": "pubchem.props.SMILES"
      }
    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
        "InChI=1S/C21H41NO4/c1-4-5-6-7-8-9-10-11-12-13-20(24)26-19-21(2,3)18-22-14-16-25-17-15-23/h18,23H,4-17,19H2,1-3H3"
      ],
      "rdfs:label": "InChI",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478"
        ],
        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "[3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethyl-propyl] dodecanoate",
        "[3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethylpropyl] dodecanoate",
        "[3-[2-(2-hydroxyethyloxy)ethylimino]-2,2-dimethyl-propyl] dodecanoate",
        "dodecanoic acid [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethylpropyl] ester",
        "lauric acid [3-[2-(2-hydroxyethoxy)ethylimino]-2,2-dimethyl-propyl] ester"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "skos:definition": [],
  "references": [
    {
      "@id": "https://chem.echa.europa.eu/100.148.903",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478;CAS:931419-77-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[931419-77-1]"
      }
    },
    {
      "@id": "https://commonchemistry.cas.org/detail?cas_rn=931419-77-1",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478;CAS:931419-77-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[931419-77-1]"
      }
    },
    {
      "@id": "https://comptox.epa.gov/dashboard/DTXSID60893793",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478;CAS:931419-77-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[931419-77-1]"
      }
    },
    {
      "@id": "https://pubchem.ncbi.nlm.nih.gov/compound/89999478",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_compound",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478;CAS:931419-77-1"
        ],
        "prov:wasDerivedFrom": "pubchem.by_cas[931419-77-1]"
      }
    },
    {
      "@id": "https://www.wikidata.org/wiki/Q81987763",
      "provenance": {
        "prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CID:89999478;CAS:931419-77-1"
        ],
        "prov:wasDerivedFrom": "pubchem.identifiers[931419-77-1]"
      }
    }
  ],
  "altLabel": [
    {
      "@value": "3-[[2-(2-Hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl dodecanoate",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:931419-77-1",
          "https://commonchemistry.cas.org/detail?cas_rn=931419-77-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    },
    {
      "@value": "Dodecanoic acid, 3-[[2-(2-hydroxyethoxy)ethyl]imino]-2,2-dimethylpropyl ester",
      "@language": "en",
      "source": {
        "prov:wasGeneratedBy": "consensus_match",
        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "CAS:931419-77-1",
          "https://commonchemistry.cas.org/detail?cas_rn=931419-77-1"
        ],
        "prov:wasDerivedFrom": "common chemistry CAS lookup"
      }
    }
  ],
  "cas_match_labels": {
    "931419-77-1": "exactMatch"
  },
  "http://www.w3.org/2002/07/owl#deprecated": true,
  "http://purl.org/dc/terms/isReplacedBy": "urn:uuid:944d4d0a-cced-4c6f-a03e-00e2ab22ffb6",
  "is_replaced_by_uuid": "944d4d0a-cced-4c6f-a03e-00e2ab22ffb6",
  "flow_object_id": "fo-71842226a4761fd1"
}