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Butanoic acid, 4-(4-chloro-2-methylphenoxy)-

UUID 4d9a8790-3ddd-11dd-93e0-0050c2490048
Flow Object IDfo-094e8bd798d1ae71
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 94-81-5
EC Numbers 202-365-3
prefLabel
Language Value Provenance
en Butanoic acid, 4-(4-chloro-2-methylphenoxy)-
altLabel ⓘ
Language Value Provenance
en 4-(4-chloro-2-methylphenoxy)butanoic acid
en 4-(4-chloro-o-tolyloxy)butyric acid
en (4-Chloro-<em>o</em>-tolyloxy)butyric acid
en 2,4-MCPB
en 2-Methyl-4-chlorophenoxy-γ-butyrate
en 2-Methyl-4-chlorophenoxy-γ-butyric acid
en 2-Methyl-4-chlorophenoxybutyric acid
en 2M4KhM
en 4-(2-Methyl-4-chlorophenoxy)butyric acid
en 4-(4-Chloro-2-methylphenoxy)butyric acid
en 4-(4-Chlroro-2-methylphenoxy)butanoic acid
en 4-Chloro-2-methylphenoxybutyric acid
en 4MCPB
en Bexone
en Butyric acid, 4-[(4-chloro-<em>o</em>-tolyl)oxy]-
en CMPB
en NSC 102796
en Thitrol
en Trifolex
en U46 MCPB
en γ-MCPB
en MCPB
Definitions
Language Value Provenance
en A monocarboxylic acid that is butyric acid substituted by a 2-methyl-4-chlorophenoxy group at position 4.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey LLWADFLAOKUBDR-UHFFFAOYSA-N
InChI InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)
IUPAC name 4-(4-chloranyl-2-methyl-phenoxy)butanoic acid, 4-(4-chloro-2-methyl-phenoxy)butanoic acid, 4-(4-chloro-2-methyl-phenoxy)butyric acid, 4-(4-chloro-2-methylphenoxy)butanoic acid
Molecular formula C11H13ClO3
Molecular mass 228.675
Monoisotopic mass 228.05532
SMILES CC1=C(C=CC(=C1)Cl)OCCCC(=O)O, Cc1cc(Cl)ccc1OCCCC(=O)O

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 4d9a8790-3ddd-11dd-93e0-0050c2490048 MCPB

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 MCPB Emissions/Emissions to water/Emissions to fresh water 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=mcpb||dimension=Environmental > media=Water > water_body=Unknown; cas=94-81-5; added Common Chemistry CAS names as altLabel: (4-Chloro-<em>o</em>-tolyloxy)butyric acid, 2,4-MCPB, 2-Methyl-4-chlorophenoxy-γ-butyrate, 2-Methyl-4-chlorophenoxy-γ-butyric acid, 2-Methyl-4-chlorophenoxybutyric acid, 2M4KhM, 4-(2-Methyl-4-chlorophenoxy)butyric acid, 4-(4-Chloro-2-methylphenoxy)butyric acid, 4-(4-Chlroro-2-methylphenoxy)butanoic acid, 4-Chloro-2-methylphenoxybutyric acid, 4MCPB, Bexone, Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, Butyric acid, 4-[(4-chloro-<em>o</em>-tolyl)oxy]-, CMPB, NSC 102796, Thitrol, Trifolex, U46 MCPB, γ-MCPB; object_uuid=fo-094e8bd798d1ae71
cas_match_labels 1 — consensus_match group_key=mcpb||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'94-81-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-094e8bd798d1ae71: {'94-81-5': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
altLabel [{'@value': '4-(4-chloro-2-methylphenoxy)butanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-(4-chloro-2-methylphenoxy)butanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_81806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-(4-chloro-o-tolyloxy)butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-(4-chloro-o-tolyloxy)butyric acid', 'http://purl.obolibrary.org/obo/CHEBI_81806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': '4-(4-chloro-2-methylphenoxy)butanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-(4-chloro-2-methylphenoxy)butanoic acid', 'http://purl.obolibrary.org/obo/CHEBI_81806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '4-(4-chloro-o-tolyloxy)butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:4-(4-chloro-o-tolyloxy)butyric acid', 'http://purl.obolibrary.org/obo/CHEBI_81806', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '(4-Chloro-<em>o</em>-tolyloxy)butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2,4-MCPB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methyl-4-chlorophenoxy-γ-butyrate', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methyl-4-chlorophenoxy-γ-butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2-Methyl-4-chlorophenoxybutyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '2M4KhM', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-(2-Methyl-4-chlorophenoxy)butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-(4-Chloro-2-methylphenoxy)butyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-(4-Chlroro-2-methylphenoxy)butanoic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4-Chloro-2-methylphenoxybutyric acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '4MCPB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Bexone', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butanoic acid, 4-(4-chloro-2-methylphenoxy)-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Butyric acid, 4-[(4-chloro-<em>o</em>-tolyl)oxy]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'CMPB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'NSC 102796', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Thitrol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Trifolex', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'U46 MCPB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'γ-MCPB', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:94-81-5', 'https://commonchemistry.cas.org/detail?cas_rn=94-81-5'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=mcpb||dimension=Environmental > media=Water > water_body=Unknown; cas=94-81-5; added Common Chemistry CAS names as altLabel: (4-Chloro-<em>o</em>-tolyloxy)butyric acid, 2,4-MCPB, 2-Methyl-4-chlorophenoxy-γ-butyrate, 2-Methyl-4-chlorophenoxy-γ-butyric acid, 2-Methyl-4-chlorophenoxybutyric acid, 2M4KhM, 4-(2-Methyl-4-chlorophenoxy)butyric acid, 4-(4-Chloro-2-methylphenoxy)butyric acid, 4-(4-Chlroro-2-methylphenoxy)butanoic acid, 4-Chloro-2-methylphenoxybutyric acid, 4MCPB, Bexone, Butanoic acid, 4-(4-chloro-2-methylphenoxy)-, Butyric acid, 4-[(4-chloro-<em>o</em>-tolyl)oxy]-, CMPB, NSC 102796, Thitrol, Trifolex, U46 MCPB, γ-MCPB; object_uuid=fo-094e8bd798d1ae71
cas_match_labels None {'94-81-5': 'exactMatch'} group_key=mcpb||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'94-81-5': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-094e8bd798d1ae71: {'94-81-5': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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