← Back to consensus flow objects
3-Chlorobiphenyl
| Flow Object ID | fo-e9c0423880f04e2d | ||||||
|---|---|---|---|---|---|---|---|
| Type | Consensus | ||||||
| prefLabel |
|
||||||
| Alt Labels |
|
||||||
| CAS Numbers | 11104-28-2 | ||||||
| EC Numbers | 623-280-1 | ||||||
| Changes Applied | 13 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
NMWSKOLWZZWHPL-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C12H9Cl/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H
|
| IUPAC name |
1-chloranyl-3-phenyl-benzene, 1-chloro-3-phenyl-benzene, 1-chloro-3-phenylbenzene
|
| Molecular formula |
C12H9Cl
|
| SMILES |
C1=CC=C(C=C1)C2=CC(=CC=C2)Cl
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J95.418G
- https://chem.echa.europa.eu/100.016.479
- https://chem.echa.europa.eu/100.151.974
- https://commonchemistry.cas.org/detail?cas_rn=11104-28-2
- https://commonchemistry.cas.org/detail?cas_rn=2051-61-8
- https://comptox.epa.gov/dashboard/DTXSID1040299
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/WLQ4633SJY
- https://hmdb.ca/metabolites/HMDB0245840
- https://pubchem.ncbi.nlm.nih.gov/compound/16322
- https://pubchem.ncbi.nlm.nih.gov/erg/#2315
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:36716
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55469
- https://www.wikidata.org/wiki/Q27891531
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
54286535… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 1 |
537e6191… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
0170e03e… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 1 |
5ebce1bb… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 1 |
c9d1b93c… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
d0dc4e37… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 1 |
bbb37abf… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 1 |
be3c22c1… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 1 |
80e0e90d… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 1 |
f341211e… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 1 |
ff89bae2… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
0170e03e… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
537e6191… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
54286535… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
5ebce1bb… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
80e0e90d… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
bbb37abf… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
be3c22c1… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
c9d1b93c… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
d0dc4e37… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
d17167da… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
f341211e… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
fe11c3c4… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
ff89bae2… |
cas_match_labels |
— |
{"11104-28-2":"exactMatch"} |
group_key=aroclor1221||dimension=Environmental > media=Air > strata=Ground level > population_density=Urban (>1000 people/square mile); group_sources=['pubchem']; cas_sources={'11104-28-2': ['pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-e9c0423880f04e2d: {'11104-28-2': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-e9c0423880f04e2d",
"prefLabel": [
{
"@value": "3-Chlorobiphenyl",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasAttributedTo": "consensus-flow-list",
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"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "Aroclor 1221",
"@language": "en",
"@lang": "en",
"provenance": {
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"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
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"@value": [
"C12H9Cl"
],
"rdfs:label": "Molecular formula",
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},
"https://w3id.org/chemrof/inchi2d_key_string": {
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"@value": [
"NMWSKOLWZZWHPL-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
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},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"C1=CC=C(C=C1)C2=CC(=CC=C2)Cl"
],
"rdfs:label": "SMILES",
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}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/C12H9Cl/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H"
],
"rdfs:label": "InChI",
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},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"1-chloranyl-3-phenyl-benzene",
"1-chloro-3-phenyl-benzene",
"1-chloro-3-phenylbenzene"
],
"rdfs:label": "IUPAC name",
"provenance": {
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}
},
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}