← Back to consensus flow objects
HCFC-232
| Flow Object ID | fo-b22a5b0f57a1424c | |||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| Type | Consensus | |||||||||
| prefLabel |
|
|||||||||
| Alt Labels |
|
|||||||||
| CAS Numbers |
460-89-9
|
|||||||||
| Changes Applied | 24 |
Provenance
| Field | Value |
|---|---|
| Resolver | hybrid_name_cas_v1 |
| Seed Source | EF 3.1 |
| Seed Flow | 08a91e70-3ddc-11dd-90d3-0050c2490048 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
IGOPOYHPIKTQSS-UHFFFAOYSA-N, ZLDAESRXXGCSNT-UHFFFAOYSA-N
|
| InChI |
InChI=1S/C3H2Cl4F2/c4-2(5,6)1-3(7,8)9/h1H2, InChI=1S/C3H6F3N.ClH/c4-3(5,6)1-2-7;/h1-2,7H2;1H
|
| IUPAC name |
1,1,1,3-tetrachloro-3,3-difluoro-propane, 1,1,1,3-tetrachloro-3,3-difluoropropane, 1,1,1,3-tetrakis(chloranyl)-3,3-bis(fluoranyl)propane, 3,3,3-trifluoro-1-propanamine;hydrochloride, 3,3,3-trifluoropropan-1-amine;hydrochloride, 3,3,3-trifluoropropylamine;hydrochloride, 3,3,3-tris(fluoranyl)propan-1-amine;hydrochloride
|
| Molecular formula |
C3H2Cl4F2, C3H7ClF3N
|
| Molecular mass |
217.857
|
| Monoisotopic mass |
215.887867
|
| SMILES |
C(C(F)(F)Cl)C(Cl)(Cl)Cl, C(CN)C(F)(F)F.Cl, FC(F)(Cl)CC(Cl)(Cl)Cl
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.149.497H
- https://chem.echa.europa.eu/100.197.205
- https://commonchemistry.cas.org/detail?cas_rn=2968-33-4
- https://commonchemistry.cas.org/detail?cas_rn=460-89-9
- https://comptox.epa.gov/dashboard/DTXSID10196685
- https://comptox.epa.gov/dashboard/DTXSID30649103
- https://pubchem.ncbi.nlm.nih.gov/compound/150187
- https://pubchem.ncbi.nlm.nih.gov/compound/25210505
- https://www.wikidata.org/wiki/Q72513277
- https://www.wikidata.org/wiki/Q83069707
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
0d79c5a6… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 0 | 2 |
08a91e70… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 0 | 2 |
4d9a8790… |
EF 3.1 | kg | Environmental → Air → Unknown | 0 | 2 |
0d79c5a4… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 0 | 2 |
0d79c5a7… |
EF 3.1 | kg | Environmental → Ground → Unknown | 0 | 2 |
0d79c5a8… |
EF 3.1 | kg | Environmental → Water → Ocean | 0 | 2 |
0d79c5a5… |
EF 3.1 | kg | Environmental → Water → Surface water | 0 | 2 |
0d79c5aa… |
EF 3.1 | kg | Environmental → Water → Unknown | 0 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
08a91e70… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
08a91e70… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a4… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a4… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a5… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a5… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a6… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a6… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a7… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a7… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a8… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a8… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5a9… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5a9… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5aa… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5aa… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
0d79c5ab… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
0d79c5ab… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
4d9a8790… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
4d9a8790… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
4d9a8790… |
altLabel |
— |
[{"@value":"1,1,1,3-Tetrachloro-3,3-difluoropropane","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}},{"@value":"Propane, 1,1,1,3-tetrachloro-3,3-difluoro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:460-89-9","https://commonchemistry.cas.org/detail?cas_rn=460-89-9"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=460-89-9; added Common Chemistry CAS names as altLabel: 1,1,1,3-Tetrachloro-3,3-difluoropropane, Propane, 1,1,1,3-tetrachloro-3,3-difluoro-; object_uuid=fo-b22a5b0f57a1424c |
4d9a8790… |
cas_match_labels |
— |
{"460-89-9":"exactMatch"} |
group_key=hcfc-232||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=[]; cas_sources={'460-89-9': []}; assigned CAS labels from group consensus; object_uuid=fo-b22a5b0f57a1424c: {'460-89-9': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-b22a5b0f57a1424c",
"prefLabel": [
{
"@value": "HCFC-232",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [
{
"@value": "1,1,1,3-Tetrachloro-3,3-difluoropropane",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
},
{
"@value": "Propane, 1,1,1,3-tetrachloro-3,3-difluoro-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "altLabel"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C3H2Cl4F2",
"C3H7ClF3N"
],
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:150187",
"CID:25210505"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(C(F)(F)Cl)C(Cl)(Cl)Cl"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"IGOPOYHPIKTQSS-UHFFFAOYSA-N",
"ZLDAESRXXGCSNT-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
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],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(C(F)(F)Cl)C(Cl)(Cl)Cl"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
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