2-bromo-1,1,1-trifluoroethane
fe0acd60-3ddc-11dd-a0fa-0050c2490048
Deprecated
Replaced by 9308661e-e251-11e6-bf01-fe55135034f3 .
Identity
- Substance
- fo-f9395b6ddd22a915 Neutral molecule
- Source
- EF 3.1
- Unit
- kg
- Context
- Environmental → Air → Ground level → Urban (>1000 people/square mile)
- CAS
- 421-06-7
- EC
- 207-001-7
Context
- Dimension
- Environmental
- Media
- Air
- Population density
- Urban (>1000 people/square mile)
- Strata
- Ground level
Alternative labels
6- 1,1,1-Trifluoro-2-bromoethane
- 1-Bromo-2,2,2-trifluoroethane
- 2,2,2-Trifluoroethyl bromide
- 2-Bromo-trifluoroethane
- Ethane, 2-bromo-1,1,1-trifluoro-
- HBFC 133aB1
Source lists
1| List | Version | Source flow | Name there | Why this flow |
|---|---|---|---|---|
| EF | 3.1 | fe0acd60-3ddc-11dd-a0fa-0050c2490048 | 2-bromo-1,1,1-trifluoroethane | The consensus list is built from this one, so this row is the flow itself rather than something matched to it. |
History
The change log and the PROV-O trail (2 consensus changes)
These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.
Full record
Flow JSON
{
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C2H2BrF3"
],
"attested_by": {
"C2H2BrF3": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"TZNJHEHAYZJBHR-UHFFFAOYSA-N"
],
"attested_by": {
"TZNJHEHAYZJBHR-UHFFFAOYSA-N": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"FC(F)(F)CBr"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-bromo-1,1,1-trifluoroethane"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
],
"attested_by": {
"FC(F)(F)CBr": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C2H2BrF3/c3-1-2(4,5)6/h1H2"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-bromo-1,1,1-trifluoroethane"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
],
"attested_by": {
"InChI=1S/C2H2BrF3/c3-1-2(4,5)6/h1H2": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"2-bromo-1,1,1-trifluoroethane"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"2-bromo-1,1,1-trifluoroethane"
]
},
"attested_by": {
"2-bromo-1,1,1-trifluoroethane": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
162.936
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(C(F)(F)F)Br"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
],
"attested_by": {
"162.936": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
161.929197
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C(C(F)(F)F)Br"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"FC(F)(F)CBr"
]
}
],
"attested_by": {
"161.929197": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J150.049J",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.006.366",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=30283-91-1",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=421-06-7",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID2074324",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/8L33M92UWM",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/67898",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.by_cas[421-06-7]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q27270694",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:67898;CAS:421-06-7"
],
"prov:wasDerivedFrom": "pubchem.identifiers[421-06-7]"
}
}
],
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"http://www.w3.org/2004/02/skos/core#definition": [],
"uuid": "fe0acd60-3ddc-11dd-a0fa-0050c2490048",
"identifier": "fe0acd60-3ddc-11dd-a0fa-0050c2490048",
"source": "EF 3.1",
"cas_numbers": [
"421-06-7"
],
"ec_numbers": [
"207-001-7"
],
"context": {
"dimension": "Environmental",
"media": "Air",
"strata": "Ground level",
"population_density": "Urban (>1000 people/square mile)"
},
"synonyms": [],
"lcia_methods": [],
"unit": "kg",
"input_datasets": [
"EF 3.1"
],
"prefLabel": [
{
"@value": "2-bromo-1,1,1-trifluoroethane",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "1,1,1-Trifluoro-2-bromoethane",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "1-Bromo-2,2,2-trifluoroethane",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2,2,2-Trifluoroethyl bromide",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "2-Bromo-trifluoroethane",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Ethane, 2-bromo-1,1,1-trifluoro-",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "HBFC 133aB1",
"@language": "en",
"source": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:421-06-7",
"https://commonchemistry.cas.org/detail?cas_rn=421-06-7"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"context_iri": "https://vocab.brightway.one/flow-contexts/envi-air-grle-ur10pesq",
"unit_iri": "https://vocab.brightway.one/units/unit/KiloGM",
"flow_object_id": "fo-f9395b6ddd22a915",
"concept_associations": [],
"http://www.w3.org/2002/07/owl#deprecated": true,
"http://purl.org/dc/terms/isReplacedBy": "urn:uuid:9308661e-e251-11e6-bf01-fe55135034f3",
"is_replaced_by_uuid": "9308661e-e251-11e6-bf01-fe55135034f3",
"_sources": {
"prefLabel": "bootstrap_labels",
"name": "bootstrap_labels",
"synonyms": "bootstrap_labels",
"context": "default_context_mapping",
"context_iri": "default_context_mapping",
"unit_iri": "unit_normalization",
"ec_numbers": "ec_cross_check",
"properties": "normalise_property_values",
"skos_definition": "enrich_references",
"references": "enrich_references",
"altLabel": "consensus_match",
"cas_match_labels": "consensus_match",
"owl_deprecated": "pipeline.deduplication",
"dcterms_is_replaced_by": "pipeline.deduplication",
"is_replaced_by_uuid": "pipeline.deduplication",
"types": "link_flows_to_their_substance"
},
"cas_match_labels": {
"421-06-7": "exactMatch"
},
"_transformed": true,
"_provided": {
"name": "2-bromo-1,1,1-trifluoroethane",
"synonyms": [
"2,2,2-Trifluoroethyl bromide",
"AC1L28KW",
"AC1Q27KP",
"Bromotrifluoroethane",
"Ethane, 2-bromo-1,1,1-trifluoro-",
"FT-0081255",
"Trifluorobromoethane"
],
"context": [
"Emissions",
"Emissions to air",
"Emissions to urban air close to ground"
],
"cas_numbers": [
"421-06-7"
],
"ec_numbers": [],
"unit": "kg"
}
}
Something wrong here?
A flow can be wrong in three ways, and they are decided differently. Pick the one that matches what you are looking at.
- A row from my list should not reach this flow
- This flow is not that chemical
- The compartment or the unit is wrong
You do not need to run a build or clone anything. Name the row and say what your evidence is; the measurement is done for you. How contributing works