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(S)-(-)-2-Chloropropionic acid

UUID c6e0e671-c2c9-487c-8d33-3a69cc49067c
Flow Object IDfo-31e1fced120f26bc
Source EF 3.1
Context Environmental → Ground → Agricultural
CAS Numbers 29617-66-1
EC Numbers 411-150-5
prefLabel
Language Value Provenance
en (S)-(-)-2-Chloropropionic acid
altLabel
Language Value Provenance
en (2S)-2-chloropropanoic acid
en (S)-alpha-chloropropanoic acid
en (S)-alpha-chloropropionic acid
en L-2-Chloropropanoic acid
en L-2-Chloropropionic acid
en alpha-L-Chloropropionic acid
en (-)-2-Chloropropanoic acid
en (-)-2-Chloropropionic acid
en (-)-α-Chloropropanoic acid
en (2<em>S</em>)-2-Chloropropanoic acid
en (2<em>S</em>)-2-Chloropropionic acid
en (2<em>S</em>)-Chloropropanoic acid
en (<em>S</em>)-2-Chloropropanoic acid
en (<em>S</em>)-2-Chloropropionic acid
en (<em>S</em>)-α-Chloropropionic acid
en 2(<em>S</em>)-Chloropropionic acid
en 2-Chloro-<span class="text-smallcaps">L</span>-propionic acid
en <em>S</em>-(-)-2-Chloropropionic acid
en <span class="text-smallcaps">L</span>-2-Chloropropanoic acid
en <span class="text-smallcaps">L</span>-2-Chloropropionic acid
en Propanoic acid, 2-chloro-, (2<em>S</em>)-
en Propanoic acid, 2-chloro-, (<em>S</em>)-
en Propionic acid, 2-chloro-, <span class="text-smallcaps">L</span>-
en α-<span class="text-smallcaps">L</span>-Chloropropionic acid
en (s)-2-chloropropionic Acid
Definitions
Language Value Provenance
en A monocarboxylic acid that is propanoic acid substituted at position 2 by a chloro group (the S-enantiomer).
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey GAWAYYRQGQZKCR-REOHCLBHSA-N
InChI InChI=1S/C3H5ClO2/c1-2(4)3(5)6/h2H,1H3,(H,5,6)/t2-/m0/s1
IUPAC name (2S)-2-chloranylpropanoic acid, (2S)-2-chloropropanoic acid, (2S)-2-chloropropionic acid
Molecular formula C3H5ClO2
Molecular mass 108.524
Monoisotopic mass 107.99781
SMILES CC(C(=O)O)Cl, C[C@@H](C(=O)O)Cl, C[C@H](Cl)C(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 c6e0e671-c2c9-487c-8d33-3a69cc49067c (s)-2-chloropropionic acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 (s)-2-chloropropionic acid Emissions/Emissions to soil/Emissions to agricultural soil kg exactMatch

Consolidated Field Provenance

0 total PROV activity record(s) for this flow.

Field Change Count Latest Time Transformers Latest Comment
altLabel 1 consensus_match group_key=(s)-2-chloropropionicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=29617-66-1; added Common Chemistry CAS names as altLabel: (-)-2-Chloropropanoic acid, (-)-2-Chloropropionic acid, (-)-α-Chloropropanoic acid, (2<em>S</em>)-2-Chloropropanoic acid, (2<em>S</em>)-2-Chloropropionic acid, (2<em>S</em>)-Chloropropanoic acid, (<em>S</em>)-2-Chloropropanoic acid, (<em>S</em>)-2-Chloropropionic acid, (<em>S</em>)-α-Chloropropionic acid, 2(<em>S</em>)-Chloropropionic acid, 2-Chloro-<span class="text-smallcaps">L</span>-propionic acid, <em>S</em>-(-)-2-Chloropropionic acid, <span class="text-smallcaps">L</span>-2-Chloropropanoic acid, <span class="text-smallcaps">L</span>-2-Chloropropionic acid, Propanoic acid, 2-chloro-, (2<em>S</em>)-, Propanoic acid, 2-chloro-, (<em>S</em>)-, Propionic acid, 2-chloro-, <span class="text-smallcaps">L</span>-, α-<span class="text-smallcaps">L</span>-Chloropropionic acid; object_uuid=fo-31e1fced120f26bc
cas_match_labels 1 consensus_match group_key=(s)-2-chloropropionicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'pubchem']; cas_sources={'29617-66-1': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-31e1fced120f26bc: {'29617-66-1': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyAgricultural

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '(2S)-2-chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2S)-2-chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(S)-alpha-chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(S)-alpha-chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(S)-alpha-chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(S)-alpha-chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'L-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:L-2-Chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'L-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:L-2-Chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-L-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-L-Chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(2S)-2-chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(2S)-2-chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(S)-alpha-chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(S)-alpha-chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(S)-alpha-chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(S)-alpha-chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'L-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:L-2-Chloropropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'L-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:L-2-Chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-L-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-L-Chloropropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_73956', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(-)-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(-)-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(-)-α-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(2<em>S</em>)-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(2<em>S</em>)-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(2<em>S</em>)-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>S</em>)-α-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2(<em>S</em>)-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Chloro-<span class="text-smallcaps">L</span>-propionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>S</em>-(-)-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<span class="text-smallcaps">L</span>-2-Chloropropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<span class="text-smallcaps">L</span>-2-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propanoic acid, 2-chloro-, (2<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propanoic acid, 2-chloro-, (<em>S</em>)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Propionic acid, 2-chloro-, <span class="text-smallcaps">L</span>-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-<span class="text-smallcaps">L</span>-Chloropropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:29617-66-1', 'https://commonchemistry.cas.org/detail?cas_rn=29617-66-1'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=(s)-2-chloropropionicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; cas=29617-66-1; added Common Chemistry CAS names as altLabel: (-)-2-Chloropropanoic acid, (-)-2-Chloropropionic acid, (-)-α-Chloropropanoic acid, (2<em>S</em>)-2-Chloropropanoic acid, (2<em>S</em>)-2-Chloropropionic acid, (2<em>S</em>)-Chloropropanoic acid, (<em>S</em>)-2-Chloropropanoic acid, (<em>S</em>)-2-Chloropropionic acid, (<em>S</em>)-α-Chloropropionic acid, 2(<em>S</em>)-Chloropropionic acid, 2-Chloro-<span class="text-smallcaps">L</span>-propionic acid, <em>S</em>-(-)-2-Chloropropionic acid, <span class="text-smallcaps">L</span>-2-Chloropropanoic acid, <span class="text-smallcaps">L</span>-2-Chloropropionic acid, Propanoic acid, 2-chloro-, (2<em>S</em>)-, Propanoic acid, 2-chloro-, (<em>S</em>)-, Propionic acid, 2-chloro-, <span class="text-smallcaps">L</span>-, α-<span class="text-smallcaps">L</span>-Chloropropionic acid; object_uuid=fo-31e1fced120f26bc
cas_match_labels None {'29617-66-1': 'exactMatch'} group_key=(s)-2-chloropropionicacid||dimension=Environmental > media=Air > strata=High stack, >150 meters; group_sources=['chebi', 'pubchem']; cas_sources={'29617-66-1': ['chebi', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-31e1fced120f26bc: {'29617-66-1': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

{
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  "name": null,
  "cas_numbers": [
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  "ec_numbers": [
    "411-150-5"
  ],
  "context": {
    "dimension": "Environmental",
    "media": "Ground",
    "geography": "Agricultural"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "method_uuid": "05316e7a-b254-4bea-9cf0-6bf33eb5c630",
      "name": "Ecotoxicity, freshwater",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 184.28
    },
    {
      "method_uuid": "fd530f00-9325-424a-92ef-aaac67922fd9",
      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 184.28
    }
  ],
  "source": "EF 3.1",
  "identifier": "c6e0e671-c2c9-487c-8d33-3a69cc49067c",
  "input_datasets": [
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  "source_refs": [
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      "source_flow_name": "(s)-2-chloropropionic acid",
      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to soil",
          "Emissions to agricultural soil"
        ]
      }
    }
  ],
  "prefLabel": [
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  "properties": {
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      "rdfs:label": "Molecular formula",
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      "rdfs:label": "SMILES",
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