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3,5-diethylheptane

Flow Object IDfo-6fa03b8bda27344c
TypeConsensus
prefLabel
Label Language
3,5-diethylheptane en
CAS Numbers61869-02-1
Changes Applied12

Properties

Predicate Value
InChIKey OBHTWTQZINRNAB-UHFFFAOYSA-N
InChI InChI=1S/C11H24/c1-5-10(6-2)9-11(7-3)8-4/h10-11H,5-9H2,1-4H3
IUPAC name 3,5-diethylheptane
Molecular formula C11H24
SMILES CCC(CC)CC(CC)CC

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
3e4d7795… EF 3.1 kg Environmental → Air → Aircraft cruise height 0 1
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 1
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 0 1
fe0acd60… EF 3.1 kg Environmental → Air → High stack, >150 meters 0 1
fe0acd60… EF 3.1 kg Environmental → Air → Unknown 0 1
3e4d7793… EF 3.1 kg Environmental → Ground → Agricultural 0 1
3e4d7796… EF 3.1 kg Environmental → Ground → Unknown 0 1
3e4d7797… EF 3.1 kg Environmental → Water → Ocean 0 1
3e4d7794… EF 3.1 kg Environmental → Water → Surface water 0 1
3e4d7799… EF 3.1 kg Environmental → Water → Unknown 0 1
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
3e4d7793… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7794… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7795… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7796… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7797… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7798… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d7799… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
3e4d779a… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
fe0acd60… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
fe0acd60… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
fe0acd60… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}
fe0acd60… cas_match_labels — {"61869-02-1":"exactMatch"} group_key=3,5-diethylheptane||dimension=Environmental > media=Ground > geography=Agricultural; group_sources=['pubchem']; cas_sources={'61869-02-1': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-6fa03b8bda27344c: {'61869-02-1': 'exactMatch'}

Flow Object JSON

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  "flow_object_id": "fo-6fa03b8bda27344c",
  "prefLabel": [
    {
      "@value": "3,5-diethylheptane",
      "@language": "en",
      "@lang": "en",
      "provenance": {
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        "prov:wasAttributedTo": "consensus-flow-list",
        "prov:hadPrimarySource": [
          "EF 3.1"
        ],
        "prov:wasDerivedFrom": "prefLabel"
      }
    }
  ],
  "altLabel": [],
  "properties": {
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      "@id": "https://w3id.org/chemrof/molecular_formula",
      "@value": [
        "C11H24"
      ],
      "rdfs:label": "Molecular formula",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
      }
    },
    "https://w3id.org/chemrof/inchi2d_key_string": {
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      "@value": [
        "OBHTWTQZINRNAB-UHFFFAOYSA-N"
      ],
      "rdfs:label": "InChIKey",
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        "prov:wasDerivedFrom": "pubchem.props.InChIKey"
      }
    },
    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CCC(CC)CC(CC)CC"
      ],
      "rdfs:label": "SMILES",
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    },
    "https://w3id.org/chemrof/inchi2d_string": {
      "@id": "https://w3id.org/chemrof/inchi2d_string",
      "@value": [
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      ],
      "rdfs:label": "InChI",
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        "prov:wasDerivedFrom": "pubchem.props.InChI"
      }
    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "3,5-diethylheptane"
      ],
      "rdfs:label": "IUPAC name",
      "provenance": {
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        "prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
      }
    }
  },
  "references": [
    {
      "@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.013.305J",
      "provenance": {
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        "prov:hadPrimarySource": [
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        "prov:wasDerivedFrom": "pubchem.identifiers[61869-02-1]"
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    {
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    {
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        "prov:wasDerivedFrom": "pubchem.by_cas[61869-02-1]"
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    },
    {
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      }
    }
  ],
  "created_from": {
    "resolver": "hybrid_name_cas_v1",
    "seed_uuid": "3e4d7793-6556-11dd-ad8b-0800200c9a66",
    "seed_source": "EF 3.1"
  },
  "classifications": {
    "http://semanticscience.org/resource/CHEMINF_000446": {
      "@value": [
        "61869-02-1"
      ],
      "rdfs:seeAlso": [
        "https://commonchemistry.cas.org/detail?cas_rn=61869-02-1"
      ],
      "skos:exactMatch": [
        {
          "@id": "https://commonchemistry.cas.org/detail?cas_rn=61869-02-1"
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      ],
      "provenance": {
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        "prov:wasDerivedFrom": "cas_numbers"
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  "origin_qualifier": null,
  "parent_flow_object_id": null
}