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1,4-Cyclohexanedicarboxylic acid

UUID 874a1918-81e1-4c76-8b6f-6dc8150a1e9f
Deprecated yes
Replaced By 75471a51-75c5-4504-91eb-4656ebf5f29e
Flow Object IDfo-7f741515f76baca8
Source EF 3.1
Context Environmental → Ground → Unknown
CAS Numbers 1076-97-7
EC Numbers 214-068-6
prefLabel ⓘ
Language Value Provenance
en 1,4-Cyclohexanedicarboxylic acid
altLabel ⓘ
Language Value Provenance
en hexahydroterephthalic acid
en 1,4-Benzenedicarboxylic acid, hexahydro-
en 1,4-CHDA
en 1,4-CHDA-HP
en 1,4-Dicarboxycyclohexane
en Rikacid CHDA
Definitions
Language Value Provenance
en A dicarboxylic acid that is cyclohexane substituted by carboxy groups at positions 1 and 4.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey PXGZQGDTEZPERC-UHFFFAOYSA-N
InChI InChI=1S/C8H12O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)
IUPAC name cyclohexane-1,4-dicarboxylic acid
Molecular formula C8H12O4
Molecular mass 172.18
Monoisotopic mass 172.07356
SMILES C1CC(CCC1C(=O)O)C(=O)O, O=C(O)C1CCC(C(=O)O)CC1

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 874a1918-81e1-4c76-8b6f-6dc8150a1e9f cyclohexane-1,4-dicarboxylic acid

Consolidated Field Provenance

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

Field Change Count Latest Time Transformers Latest Comment
altLabel 2 — consensus_match group_key=cyclohexane-1,4-dicarboxylicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=1076-97-7; added Common Chemistry CAS names as altLabel: 1,4-Benzenedicarboxylic acid, hexahydro-, 1,4-CHDA, 1,4-CHDA-HP, 1,4-Dicarboxycyclohexane, Rikacid CHDA; object_uuid=fo-7f741515f76baca8
cas_match_labels 1 — consensus_match group_key=cyclohexane-1,4-dicarboxylicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1076-97-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f741515f76baca8: {'1076-97-7': 'exactMatch'}
prefLabel 1 — consensus_match cas=1076-97-7; cc_chebi_agreed_name='1,4-Cyclohexanedicarboxylic acid'; object_uuid=fo-7f741515f76baca8

Context Attributes

AttributeValue
dimensionEnvironmental
mediaGround
geographyUnknown

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': 'Cyclohexane-1,4-dicarboxylic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '1,4-Cyclohexanedicarboxylic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=1076-97-7; cc_chebi_agreed_name='1,4-Cyclohexanedicarboxylic acid'; object_uuid=fo-7f741515f76baca8
altLabel [{'@value': 'hexahydroterephthalic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:hexahydroterephthalic acid', 'http://purl.obolibrary.org/obo/CHEBI_145052', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}] [{'@value': 'hexahydroterephthalic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:hexahydroterephthalic acid', 'http://purl.obolibrary.org/obo/CHEBI_145052', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Cyclohexane-1,4-dicarboxylic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] cas=1076-97-7; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-7f741515f76baca8
altLabel [{'@value': 'hexahydroterephthalic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:hexahydroterephthalic acid', 'http://purl.obolibrary.org/obo/CHEBI_145052', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': 'Cyclohexane-1,4-dicarboxylic Acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'original name retained as altLabel'}}] [{'@value': 'hexahydroterephthalic acid', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'chebi_altlabels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['label:hexahydroterephthalic acid', 'http://purl.obolibrary.org/obo/CHEBI_145052', 'EF 3.1'], 'prov:wasDerivedFrom': 'chebi synonym match'}}, {'@value': '1,4-Benzenedicarboxylic acid, hexahydro-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7', 'https://commonchemistry.cas.org/detail?cas_rn=1076-97-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-CHDA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7', 'https://commonchemistry.cas.org/detail?cas_rn=1076-97-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-CHDA-HP', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7', 'https://commonchemistry.cas.org/detail?cas_rn=1076-97-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '1,4-Dicarboxycyclohexane', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7', 'https://commonchemistry.cas.org/detail?cas_rn=1076-97-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'Rikacid CHDA', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:1076-97-7', 'https://commonchemistry.cas.org/detail?cas_rn=1076-97-7'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=cyclohexane-1,4-dicarboxylicacid||dimension=Environmental > media=Water > water_body=Unknown; cas=1076-97-7; added Common Chemistry CAS names as altLabel: 1,4-Benzenedicarboxylic acid, hexahydro-, 1,4-CHDA, 1,4-CHDA-HP, 1,4-Dicarboxycyclohexane, Rikacid CHDA; object_uuid=fo-7f741515f76baca8
cas_match_labels None {'1076-97-7': 'exactMatch'} group_key=cyclohexane-1,4-dicarboxylicacid||dimension=Environmental > media=Water > water_body=Unknown; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'1076-97-7': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-7f741515f76baca8: {'1076-97-7': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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