← Back to consensus flow objects
4-n-Heptylphenol
| Flow Object ID | fo-24920a53fe93db19 | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||
| prefLabel |
|
|||||||||
| Alt Labels |
|
|||||||||
| CAS Numbers | 72624-02-3 | |||||||||
| EC Numbers | 276-743-1 | |||||||||
| Changes Applied | 26 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
KNDDEFBFJLKPFE-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C13H20O/c1-2-3-4-5-6-7-12-8-10-13(14)11-9-12/h8-11,14H,2-7H2,1H3
|
| IUPAC name |
4-heptylphenol
|
| Molecular formula |
C13H20O
|
| SMILES |
CCCCCCCC1=CC=C(C=C1)O
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J141.393G
- https://chem.echa.europa.eu/100.016.239
- https://commonchemistry.cas.org/detail?cas_rn=1987-50-4
- https://commonchemistry.cas.org/detail?cas_rn=72624-02-3
- https://comptox.epa.gov/dashboard/DTXSID2037714
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/I743Z35DVB
- https://hmdb.ca/metabolites/HMDB0246435
- https://platform.opentargets.org/drug/CHEMBL149752
- https://pubchem.ncbi.nlm.nih.gov/compound/16143
- https://www.drugbank.ca/drugs/DB03941
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34438
- https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL149752
- https://www.kegg.jp/entry/C14698
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=148423
- https://www.wikidata.org/wiki/Q27094802
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
b2209f9b… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 4 | 2 |
f189b316… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
48166006… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 4 | 2 |
812a96a4… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 4 | 2 |
35f3d9c4… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
6b169b02… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 2 |
94fd0344… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 4 | 2 |
5cc93a65… |
EF 3.1 | kg | Environmental → Ground → Unknown | 4 | 2 |
df1b48fc… |
EF 3.1 | kg | Environmental → Water → Ocean | 4 | 2 |
e207a86d… |
EF 3.1 | kg | Environmental → Water → Surface water | 4 | 2 |
8ca60955… |
EF 3.1 | kg | Environmental → Water → Unknown | 4 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
35f3d9c4… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
35f3d9c4… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
48166006… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
48166006… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
5cc93a65… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
5cc93a65… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
6b169b02… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
6b169b02… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
812a96a4… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
812a96a4… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
88250181… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
88250181… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
8ca60955… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
8ca60955… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
94fd0344… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
94fd0344… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
b2209f9b… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
b2209f9b… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
ba88549c… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
ba88549c… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
df1b48fc… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
df1b48fc… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
e207a86d… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
e207a86d… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
f189b316… |
altLabel |
— |
[{"@value":"Phenol, heptyl derivs.","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:72624-02-3","https://commonchemistry.cas.org/detail?cas_rn=72624-02-3"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; cas=72624-02-3; added Common Chemistry CAS names as altLabel: Phenol, heptyl derivs.; object_uuid=fo-24920a53fe93db19 |
f189b316… |
cas_match_labels |
— |
{"72624-02-3":"exactMatch"} |
group_key=4-heptylphenol||dimension=Environmental > media=Air > strata=Unknown; group_sources=['ec_inventory']; cas_sources={'72624-02-3': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-24920a53fe93db19: {'72624-02-3': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-24920a53fe93db19",
"prefLabel": [
{
"@value": "4-n-Heptylphenol",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "4-heptylphenol",
"@language": "en",
"@lang": "en",
"provenance": {
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"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "Phenol, heptyl derivs.",
"@language": "en",
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}
],
"properties": {
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"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C13H20O"
],
"rdfs:label": "Molecular formula",
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},
"https://w3id.org/chemrof/inchi2d_key_string": {
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"@value": [
"KNDDEFBFJLKPFE-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
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},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CCCCCCCC1=CC=C(C=C1)O"
],
"rdfs:label": "SMILES",
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}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C13H20O/c1-2-3-4-5-6-7-12-8-10-13(14)11-9-12/h8-11,14H,2-7H2,1H3"
],
"rdfs:label": "InChI",
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}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"4-heptylphenol"
],
"rdfs:label": "IUPAC name",
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},
"references": [
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{
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{
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},
{
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{
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{
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{
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