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3-nitro-3-hexene

Flow Object IDfo-bb9a22646a475c5f
TypeConsensus
prefLabel
Label Language
3-nitro-3-hexene en
Alt Labels
Label Language Provenance
3-Hexene, 3-nitro- en —
CAS Numbers4812-22-0
Changes Applied26

Properties

Predicate Value
InChIKey CHIVWJRQUCXGLC-ZZXKWVIFSA-N, LDKGEUAGEISBIX-AATRIKPKSA-N, LDKGEUAGEISBIX-UHFFFAOYSA-N, LDKGEUAGEISBIX-WAYWQWQTSA-N
InChI InChI=1S/C6H11NO2/c1-3-5-6(4-2)7(8)9/h5H,3-4H2,1-2H3, InChI=1S/C6H11NO2/c1-3-5-6(4-2)7(8)9/h5H,3-4H2,1-2H3/b6-5+, InChI=1S/C6H11NO2/c1-3-5-6(4-2)7(8)9/h5H,3-4H2,1-2H3/b6-5-, InChI=1S/C6H11NO2/c1-3-6(4-2)5-7(8)9/h3H,4-5H2,1-2H3/b6-3+
IUPAC name (E)-3-(nitromethyl)-2-pentene, (E)-3-(nitromethyl)pent-2-ene, (E)-3-nitro-3-hexene, (E)-3-nitrohex-3-ene, (Z)-3-nitro-3-hexene, (Z)-3-nitrohex-3-ene, 3-nitro-3-hexene, 3-nitrohex-3-ene
Molecular formula C6H11NO2
SMILES CC/C(=C\C)/C[N+](=O)[O-], CC/C=C(/CC)\[N+](=O)[O-], CC/C=C(\CC)/[N+](=O)[O-], CCC(=CC)C[N+](=O)[O-], CCC=C(CC)[N+](=O)[O-]

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
1f3199aa… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
fe0acd60… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
fe0acd60… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
c2dd4340… EF 3.1 kg Environmental → Air → Unknown 2 2
fe0acd60… EF 3.1 kg Environmental → Air → Unknown 2 2
fe0acd60… EF 3.1 kg Environmental → Ground → Agricultural 2 2
fe0acd60… EF 3.1 kg Environmental → Ground → Unknown 2 2
fe0acd60… EF 3.1 kg Environmental → Water → Ocean 2 2
fe0acd60… EF 3.1 kg Environmental → Water → Surface water 2 2
fe0acd60… EF 3.1 kg Environmental → Water → Unknown 2 2
▶

Changes Applied
Elementary Flow Field Old Value New Value Comment
1f3199aa… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
1f3199aa… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
c2dd4340… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
c2dd4340… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}
fe0acd60… altLabel — [{"@value":"3-Hexene, 3-nitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:4812-22-0","https://commonchemistry.cas.org/detail?cas_rn=4812-22-0"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; cas=4812-22-0; added Common Chemistry CAS names as altLabel: 3-Hexene, 3-nitro-; object_uuid=fo-bb9a22646a475c5f
fe0acd60… cas_match_labels — {"4812-22-0":"exactMatch"} group_key=3-nitro-3-hexene||dimension=Environmental > media=Air > strata=Aircraft cruise height; group_sources=['pubchem']; cas_sources={'4812-22-0': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-bb9a22646a475c5f: {'4812-22-0': 'exactMatch'}

Flow Object JSON

{
  "flow_object_id": "fo-bb9a22646a475c5f",
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      "@value": "3-nitro-3-hexene",
      "@language": "en",
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  "altLabel": [
    {
      "@value": "3-Hexene, 3-nitro-",
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        "prov:wasDerivedFrom": "altLabel"
      }
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  ],
  "properties": {
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      "@value": [
        "C6H11NO2"
      ],
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        "LDKGEUAGEISBIX-AATRIKPKSA-N",
        "LDKGEUAGEISBIX-UHFFFAOYSA-N",
        "LDKGEUAGEISBIX-WAYWQWQTSA-N"
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      "rdfs:label": "InChIKey",
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    "https://w3id.org/chemrof/smiles_string": {
      "@id": "https://w3id.org/chemrof/smiles_string",
      "@value": [
        "CC/C(=C\\C)/C[N+](=O)[O-]",
        "CC/C=C(/CC)\\[N+](=O)[O-]",
        "CC/C=C(\\CC)/[N+](=O)[O-]",
        "CCC(=CC)C[N+](=O)[O-]",
        "CCC=C(CC)[N+](=O)[O-]"
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    "https://w3id.org/chemrof/inchi2d_string": {
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        "InChI=1S/C6H11NO2/c1-3-5-6(4-2)7(8)9/h5H,3-4H2,1-2H3/b6-5+",
        "InChI=1S/C6H11NO2/c1-3-5-6(4-2)7(8)9/h5H,3-4H2,1-2H3/b6-5-",
        "InChI=1S/C6H11NO2/c1-3-6(4-2)5-7(8)9/h3H,4-5H2,1-2H3/b6-3+"
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      "rdfs:label": "InChI",
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    },
    "https://w3id.org/chemrof/IUPAC_name": {
      "@id": "https://w3id.org/chemrof/IUPAC_name",
      "@value": [
        "(E)-3-(nitromethyl)-2-pentene",
        "(E)-3-(nitromethyl)pent-2-ene",
        "(E)-3-nitro-3-hexene",
        "(E)-3-nitrohex-3-ene",
        "(Z)-3-nitro-3-hexene",
        "(Z)-3-nitrohex-3-ene",
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        "3-nitrohex-3-ene"
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      "rdfs:label": "IUPAC name",
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