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2-Phenylpropionic acid

UUID 393caace-a8d6-418a-9c2f-9fcf60d4dbc4
Flow Object IDfo-8f9861bd39097e94
Source EF 3.1
Context Environmental → Air → High stack, >150 meters
CAS Numbers 492-37-5
EC Numbers 207-752-0
prefLabel
Language Value Provenance
en 2-Phenylpropionic acid
altLabel ⓘ
Language Value Provenance
en (+-)-Hydratropasaeure
en (+-)-hydratropic acid
en 2-phenylpropanoic acid
en Hydratropasaeure
en alpha-methylbenzeneacetic acid
en alpha-methylphenylacetic acid
en alpha-phenylpropionic acid
en (<em>RS</em>)-2-Phenylpropanoic acid
en (<em>RS</em>)-2-Phenylpropionic acid
en (±)-2-Phenylpropanoic acid
en (±)-2-Phenylpropionic acid
en (±)-Hydratropic acid
en (±)-α-Methylphenylacetic acid
en <em>dl</em>-PPA
en <span class="text-smallcaps">D</smallcap><smallcap>L</span>-2-Phenylpropionic acid
en Benzeneacetic acid, α-methyl-
en NSC 245033
en NSC 42872
en α-Methylbenzeneacetic acid
en α-Methylphenylacetic acid
en α-Phenylpropanoic acid
en α-Phenylpropionic acid
en Hydratropic Acid
Definitions
Language Value Provenance
en A 2-arylpropionic acid carrying a phenyl group at position 2. It is a metabolite of α-methylstyrene (AMS), a volatile hydrocarbon.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey YPGCWEMNNLXISK-UHFFFAOYSA-N
InChI InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)
IUPAC name 2-phenylpropanoic acid, hydratropic acid
Molecular formula C9H10O2
Molecular mass 150.177
Monoisotopic mass 150.06808
SMILES CC(C(=O)O)c1ccccc1, CC(C1=CC=CC=C1)C(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 393caace-a8d6-418a-9c2f-9fcf60d4dbc4 hydratropic acid

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 hydratropic acid Emissions/Emissions to air/Emissions to non-urban air or from high stacks 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=hydratropicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=492-37-5; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-2-Phenylpropanoic acid, (<em>RS</em>)-2-Phenylpropionic acid, (±)-2-Phenylpropanoic acid, (±)-2-Phenylpropionic acid, (±)-Hydratropic acid, (±)-α-Methylphenylacetic acid, <em>dl</em>-PPA, <span class="text-smallcaps">D</smallcap><smallcap>L</span>-2-Phenylpropionic acid, Benzeneacetic acid, α-methyl-, NSC 245033, NSC 42872, α-Methylbenzeneacetic acid, α-Methylphenylacetic acid, α-Phenylpropanoic acid, α-Phenylpropionic acid; object_uuid=fo-8f9861bd39097e94
cas_match_labels 1 — consensus_match group_key=hydratropicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'492-37-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8f9861bd39097e94: {'492-37-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataHigh stack, >150 meters

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '(+-)-Hydratropasaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(+-)-Hydratropasaeure', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(+-)-hydratropic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(+-)-hydratropic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-phenylpropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-phenylpropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-phenylpropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Hydratropasaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Hydratropasaeure', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylbenzeneacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylbenzeneacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylphenylacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylphenylacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-phenylpropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '(+-)-Hydratropasaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(+-)-Hydratropasaeure', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(+-)-hydratropic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:(+-)-hydratropic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-phenylpropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-phenylpropanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '2-phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:2-phenylpropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Hydratropasaeure', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:Hydratropasaeure', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylbenzeneacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylbenzeneacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-methylphenylacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-methylphenylacetic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'alpha-phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:alpha-phenylpropionic acid', 'http://purl.obolibrary.org/obo/CHEBI_48526', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(<em>RS</em>)-2-Phenylpropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(<em>RS</em>)-2-Phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(±)-2-Phenylpropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(±)-2-Phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(±)-Hydratropic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '(±)-α-Methylphenylacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<em>dl</em>-PPA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '<span class="text-smallcaps">D</smallcap><smallcap>L</span>-2-Phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Benzeneacetic acid, α-methyl-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 245033', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 42872', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Methylbenzeneacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Methylphenylacetic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Phenylpropanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'α-Phenylpropionic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:492-37-5', 'https://commonchemistry.cas.org/detail?cas_rn=492-37-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=hydratropicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=492-37-5; added Common Chemistry CAS names as altLabel: (<em>RS</em>)-2-Phenylpropanoic acid, (<em>RS</em>)-2-Phenylpropionic acid, (±)-2-Phenylpropanoic acid, (±)-2-Phenylpropionic acid, (±)-Hydratropic acid, (±)-α-Methylphenylacetic acid, <em>dl</em>-PPA, <span class="text-smallcaps">D</smallcap><smallcap>L</span>-2-Phenylpropionic acid, Benzeneacetic acid, α-methyl-, NSC 245033, NSC 42872, α-Methylbenzeneacetic acid, α-Methylphenylacetic acid, α-Phenylpropanoic acid, α-Phenylpropionic acid; object_uuid=fo-8f9861bd39097e94
cas_match_labels None {'492-37-5': 'exactMatch'} group_key=hydratropicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'492-37-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-8f9861bd39097e94: {'492-37-5': '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": [
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  ],
  "context": {
    "dimension": "Environmental",
    "media": "Air",
    "strata": "High stack, >150 meters"
  },
  "general_comment": null,
  "synonyms": [],
  "unit": "kg",
  "lcia_methods": [
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      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 7.4008
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    {
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      "name": "Ecotoxicity, freshwater_organics",
      "methodology": "Environmental Footprint",
      "impact_category": "Aquatic eco-toxicity",
      "impact_indicator": "Comparative Toxic Unit for ecosystems (CTUe) ",
      "characterization_factor": 7.4008
    }
  ],
  "source": "EF 3.1",
  "identifier": "393caace-a8d6-418a-9c2f-9fcf60d4dbc4",
  "input_datasets": [
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      "source_flow_uuid": "393caace-a8d6-418a-9c2f-9fcf60d4dbc4",
      "source_flow_name": "hydratropic acid",
      "source_metadata": {
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        "input_dataset": "EF 3.1",
        "original_context": [
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          "Emissions to air",
          "Emissions to non-urban air or from high stacks"
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  ],
  "prefLabel": [
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    "https://w3id.org/chemrof/IUPAC_name": {
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