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Isooctyldinitrophenol

Flow Object IDfo-7f4a7f86909993fa
TypeConsensus
prefLabel
Label Language
Isooctyldinitrophenol en
Alt Labels
Label Language Provenance
Phenol, isooctyldinitro- en
CAS Numbers37224-61-6
EC Numbers253-410-9
Changes Applied26

Properties

Predicate Value
InChIKey JKFMWCBNRBUHPM-UHFFFAOYSA-N, LZHVTZNVSMHVQV-UHFFFAOYSA-N
InChI InChI=1S/C14H20N2O5/c1-10(2)6-4-3-5-7-11-8-12(15(18)19)14(17)13(9-11)16(20)21/h8-10,17H,3-7H2,1-2H3, InChI=1S/C14H20N2O5/c1-10(2)6-4-3-5-7-12-13(15(18)19)8-11(17)9-14(12)16(20)21/h8-10,17H,3-7H2,1-2H3
IUPAC name 4-(6-methylheptyl)-2,6-dinitro-phenol, 4-(6-methylheptyl)-2,6-dinitrophenol, 4-(6-methylheptyl)-3,5-dinitro-phenol, 4-(6-methylheptyl)-3,5-dinitrophenol
Molecular formula C14H20N2O5
SMILES CC(C)CCCCCC1=C(C=C(C=C1[N+](=O)[O-])O)[N+](=O)[O-], CC(C)CCCCCC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-]

References

Linked Elementary Flows

UUID Source Unit Context LCIA Factors Consensus Changes
6a064547… EF 3.1 kg Environmental → Air → Aircraft cruise height 2 2
f4e5a8c1… EF 3.1 kg Environmental → Air → Ground level → Rural (<1000 people/square mile) 0 2
e4f799fb… EF 3.1 kg Environmental → Air → Ground level → Urban (>1000 people/square mile) 2 2
acfb88f5… EF 3.1 kg Environmental → Air → High stack, >150 meters 2 2
db760d49… EF 3.1 kg Environmental → Air → Unknown 2 2
e13d1083… EF 3.1 kg Environmental → Air → Unknown 2 2
4d433ceb… EF 3.1 kg Environmental → Ground → Agricultural 2 2
460a6a6d… EF 3.1 kg Environmental → Ground → Unknown 2 2
c2246328… EF 3.1 kg Environmental → Water → Ocean 2 2
5ee97c00… EF 3.1 kg Environmental → Water → Surface water 2 2
21f983d7… EF 3.1 kg Environmental → Water → Unknown 2 2

Changes Applied

Elementary Flow Field Old Value New Value Comment
21f983d7… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
21f983d7… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
2eb0fe1e… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
2eb0fe1e… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
460a6a6d… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
460a6a6d… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
4d433ceb… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
4d433ceb… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
4dd61cf1… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
4dd61cf1… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
5ee97c00… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
5ee97c00… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
6a064547… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
6a064547… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
acfb88f5… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
acfb88f5… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
c2246328… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
c2246328… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
db760d49… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
db760d49… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
e13d1083… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
e13d1083… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
e4f799fb… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
e4f799fb… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}
f4e5a8c1… altLabel [{"@value":"Phenol, isooctyldinitro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:37224-61-6","https://commonchemistry.cas.org/detail?cas_rn=37224-61-6"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; cas=37224-61-6; added Common Chemistry CAS names as altLabel: Phenol, isooctyldinitro-; object_uuid=fo-7f4a7f86909993fa
f4e5a8c1… cas_match_labels {"37224-61-6":"exactMatch"} group_key=isooctyldinitrophenol||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['ec_inventory', 'pubchem']; cas_sources={'37224-61-6': ['ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f4a7f86909993fa: {'37224-61-6': 'exactMatch'}

Flow Object JSON

{
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      "@value": "Isooctyldinitrophenol",
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  "altLabel": [
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  "properties": {
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        "InChI=1S/C14H20N2O5/c1-10(2)6-4-3-5-7-12-13(15(18)19)8-11(17)9-14(12)16(20)21/h8-10,17H,3-7H2,1-2H3"
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      "@value": [
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      }
    }
  },
  "origin_qualifier": null,
  "parent_flow_object_id": null
}