← Back to consensus flow objects
Trichloroethane
| Flow Object ID | fo-aa03f7d4e8f4766a | ||||||
|---|---|---|---|---|---|---|---|
| Type | Consensus | ||||||
| prefLabel |
|
||||||
| Alt Labels |
|
||||||
| CAS Numbers | 25323-89-1 | ||||||
| Changes Applied | 26 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
KLUSIGFSJQSFKX-UHFFFAOYSA-N, UBOXGVDOUJQMTN-UHFFFAOYSA-N, UOCLXMDMGBRAIB-UHFFFAOYSA-N
|
| InChI |
InChI=1S/2C2H3Cl3/c1-2(3,4)5;3-1-2(4)5/h1H3;2H,1H2, InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3, InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2
|
| IUPAC name |
1,1,1-trichloroethane, 1,1,1-trichloroethane;1,1,2-trichloroethane, 1,1,1-tris(chloranyl)ethane, 1,1,1-tris(chloranyl)ethane;1,1,2-tris(chloranyl)ethane, 1,1,2-trichloroethane, 1,1,2-tris(chloranyl)ethane
|
| Molecular formula |
C2H3Cl3, C4H6Cl6
|
| SMILES |
C(C(Cl)Cl)Cl, CC(Cl)(Cl)Cl, CC(Cl)(Cl)Cl.C(C(Cl)Cl)Cl
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J1.962C
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J2.376K
- https://chem.echa.europa.eu/100.000.688
- https://chem.echa.europa.eu/100.001.061
- https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0079
- https://chemicalsafety.ilo.org/dyn/icsc/showcard.display?p_card_id=0080
- https://commonchemistry.cas.org/detail?cas_rn=25323-89-1
- https://comptox.epa.gov/dashboard/DTXSID0021381
- https://comptox.epa.gov/dashboard/DTXSID5021380
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=405074
- https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=9367
- https://en.wikipedia.org/wiki/1,1,1-Trichloroethane
- https://en.wikipedia.org/wiki/1,1,2-Trichloroethane
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/113C650IR1
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/28E9ERN9WU
- https://hmdb.ca/metabolites/HMDB0041791
- https://hmdb.ca/metabolites/HMDB0244041
- https://hts.usitc.gov/search?query=2903.19.60.10
- https://hts.usitc.gov/search?query=3827.14.00.00
- https://ncithesaurus.nci.nih.gov/ncitbrowser/ConceptReport.jsp?dictionary=NCI_Thesaurus&ns=ncit&code=C75637
- https://pubchem.ncbi.nlm.nih.gov/compound/23424236
- https://pubchem.ncbi.nlm.nih.gov/compound/6278
- https://pubchem.ncbi.nlm.nih.gov/compound/6574
- https://pubchem.ncbi.nlm.nih.gov/erg/#2810
- https://pubchem.ncbi.nlm.nih.gov/erg/#2831
- https://www.cdc.gov/niosh-rtecs/KJ2D6518.html
- https://www.cdc.gov/niosh-rtecs/KJ3010B0.html
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:36015
- https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:36018
- https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL16080
- https://www.kegg.jp/entry/C18246
- https://www.kegg.jp/entry/C19536
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=49536
- https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=55256
- https://www.wikidata.org/wiki/Q161268
- https://www.wikidata.org/wiki/Q161280
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
3fc3a8d7… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 2 | 2 |
7a77bab6… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 2 |
9715e5d9… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 2 | 2 |
68440f92… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 2 | 2 |
946840f9… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
db5e8a6d… |
EF 3.1 | kg | Environmental → Air → Unknown | 2 | 2 |
51b75bf3… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 2 | 2 |
8a5c7166… |
EF 3.1 | kg | Environmental → Ground → Unknown | 2 | 2 |
1f0a46d9… |
EF 3.1 | kg | Environmental → Water → Ocean | 2 | 2 |
7ec0cfb9… |
EF 3.1 | kg | Environmental → Water → Surface water | 2 | 2 |
9e0a47a3… |
EF 3.1 | kg | Environmental → Water → Unknown | 2 | 2 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
1f0a46d9… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
1f0a46d9… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
3fc3a8d7… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
3fc3a8d7… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
51b75bf3… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
51b75bf3… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
68440f92… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
68440f92… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
7a77bab6… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
7a77bab6… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
7ec0cfb9… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
7ec0cfb9… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
8a5c7166… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
8a5c7166… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
946840f9… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
946840f9… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
9715e5d9… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
9715e5d9… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
9e0a47a3… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
9e0a47a3… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
aeaa4069… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
aeaa4069… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
d238559b… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
d238559b… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
db5e8a6d… |
altLabel |
— |
[{"@value":"Ethane, trichloro-","@language":"en","source":{"prov:wasGeneratedBy":"consensus_match","prov:wasAttributedTo":"consensus-flow-list","prov:hadPrimarySource":["CAS:25323-89-1","https://commonchemistry.cas.org/detail?cas_rn=25323-89-1"],"prov:wasDerivedFrom":"common chemistry CAS lookup"}}] |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; cas=25323-89-1; added Common Chemistry CAS names as altLabel: Ethane, trichloro-; object_uuid=fo-aa03f7d4e8f4766a |
db5e8a6d… |
cas_match_labels |
— |
{"25323-89-1":"exactMatch"} |
group_key=trichloroethane||dimension=Environmental > media=Water > water_body=Ocean; group_sources=[]; cas_sources={'25323-89-1': []}; assigned CAS labels from group consensus; object_uuid=fo-aa03f7d4e8f4766a: {'25323-89-1': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-aa03f7d4e8f4766a",
"prefLabel": [
{
"@value": "Trichloroethane",
"@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": "Ethane, trichloro-",
"@language": "en",
"@lang": "en",
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],
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}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C2H3Cl3",
"C4H6Cl6"
],
"rdfs:label": "Molecular formula",
"provenance": {
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"CID:6574",
"CID:23424236"
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"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
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},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"KLUSIGFSJQSFKX-UHFFFAOYSA-N",
"UBOXGVDOUJQMTN-UHFFFAOYSA-N",
"UOCLXMDMGBRAIB-UHFFFAOYSA-N"
],
"rdfs:label": "InChIKey",
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"prov:wasDerivedFrom": "pubchem.props.InChIKey"
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},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"C(C(Cl)Cl)Cl",
"CC(Cl)(Cl)Cl",
"CC(Cl)(Cl)Cl.C(C(Cl)Cl)Cl"
],
"rdfs:label": "SMILES",
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},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/2C2H3Cl3/c1-2(3,4)5;3-1-2(4)5/h1H3;2H,1H2",
"InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3",
"InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2"
],
"rdfs:label": "InChI",
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},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"1,1,1-trichloroethane",
"1,1,1-trichloroethane;1,1,2-trichloroethane",
"1,1,1-tris(chloranyl)ethane",
"1,1,1-tris(chloranyl)ethane;1,1,2-tris(chloranyl)ethane",
"1,1,2-trichloroethane",
"1,1,2-tris(chloranyl)ethane"
],
"rdfs:label": "IUPAC name",
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],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
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}
},
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