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Menthoxypropanediol

UUID 8d99e4b5-cd45-4bb3-8e1c-a493f7e92caa
Flow Object IDfo-ad75f147419f6fdb
Source EF 3.1
Context Environmental → Air → Ground level → Rural (<1000 people/square mile)
CAS Numbers 87061-04-9
EC Numbers 289-296-2
prefLabel ⓘ
Language Value Provenance
en Menthoxypropanediol
altLabel ⓘ
Language Value Provenance
en 1,2-Propanediol, 3-[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-
en 3-((2-Isopropyl-5-methylcyclohexyl)oxy)propane-1,2-diol
en 3-[[5-Methyl-2-(propan-2-yl)cyclohexyl]oxy]propane-1,2-diol
en FEMA 3784
en TK 10
en 3-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-1,2-propanediol
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey MDVYIGJINBYKOM-UHFFFAOYSA-N
InChI InChI=1S/C13H26O3/c1-9(2)12-5-4-10(3)6-13(12)16-8-11(15)7-14/h9-15H,4-8H2,1-3H3
IUPAC name 3-(2-isopropyl-5-methyl-cyclohexoxy)propane-1,2-diol, 3-(5-methyl-2-propan-2-yl-cyclohexyl)oxypropane-1,2-diol, 3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol
Molecular formula C13H26O3
Molecular mass 230.348
Monoisotopic mass 230.18819
SMILES CC1CCC(C(C)C)C(OCC(O)CO)C1, CC1CCC(C(C1)OCC(CO)O)C(C)C

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 8d99e4b5-cd45-4bb3-8e1c-a493f7e92caa 3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol Emissions/Emissions to air/Emissions to air, unspecified (long-term) kg exactMatch —

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=3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol||dimension=Environmental > media=Water > water_body=Surface water; cas=87061-04-9; added Common Chemistry CAS names as altLabel: 1,2-Propanediol, 3-[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-, 3-((2-Isopropyl-5-methylcyclohexyl)oxy)propane-1,2-diol, 3-[[5-Methyl-2-(propan-2-yl)cyclohexyl]oxy]propane-1,2-diol, FEMA 3784, TK 10; object_uuid=fo-ad75f147419f6fdb
cas_match_labels 1 — consensus_match group_key=3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'87061-04-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ad75f147419f6fdb: {'87061-04-9': 'exactMatch'}
prefLabel 1 — consensus_match cas=87061-04-9; cc_chebi_agreed_name='3-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-1,2-propanediol'; object_uuid=fo-ad75f147419f6fdb

Context Attributes

AttributeValue
dimensionEnvironmental
mediaAir
strataGround level
population_densityRural (<1000 people/square mile)

Consensus Changes

Field Old Value New Value Comment
prefLabel [{'@value': '3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'bootstrap_labels', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['EF 3.1'], 'prov:wasDerivedFrom': 'legacy name field'}}] [{'@value': '3-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-1,2-propanediol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9'], 'prov:wasDerivedFrom': 'Common Chemistry / ChEBI primary name agreement'}}] cas=87061-04-9; cc_chebi_agreed_name='3-[[5-Methyl-2-(1-methylethyl)cyclohexyl]oxy]-1,2-propanediol'; object_uuid=fo-ad75f147419f6fdb
altLabel None [{'@value': '3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol', '@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=87061-04-9; added original name as altLabel after CC/ChEBI rename; object_uuid=fo-ad75f147419f6fdb
altLabel [{'@value': '3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol', '@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': '1,2-Propanediol, 3-[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9', 'https://commonchemistry.cas.org/detail?cas_rn=87061-04-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-((2-Isopropyl-5-methylcyclohexyl)oxy)propane-1,2-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9', 'https://commonchemistry.cas.org/detail?cas_rn=87061-04-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': '3-[[5-Methyl-2-(propan-2-yl)cyclohexyl]oxy]propane-1,2-diol', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9', 'https://commonchemistry.cas.org/detail?cas_rn=87061-04-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'FEMA 3784', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9', 'https://commonchemistry.cas.org/detail?cas_rn=87061-04-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}, {'@value': 'TK 10', '@language': 'en', 'source': {'prov:wasGeneratedBy': 'consensus_match', 'prov:wasAttributedTo': 'consensus-flow-list', 'prov:hadPrimarySource': ['CAS:87061-04-9', 'https://commonchemistry.cas.org/detail?cas_rn=87061-04-9'], 'prov:wasDerivedFrom': 'common chemistry CAS lookup'}}] group_key=3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol||dimension=Environmental > media=Water > water_body=Surface water; cas=87061-04-9; added Common Chemistry CAS names as altLabel: 1,2-Propanediol, 3-[[5-methyl-2-(1-methylethyl)cyclohexyl]oxy]-, 3-((2-Isopropyl-5-methylcyclohexyl)oxy)propane-1,2-diol, 3-[[5-Methyl-2-(propan-2-yl)cyclohexyl]oxy]propane-1,2-diol, FEMA 3784, TK 10; object_uuid=fo-ad75f147419f6fdb
cas_match_labels None {'87061-04-9': 'exactMatch'} group_key=3-(5-methyl-2-propan-2-ylcyclohexyl)oxypropane-1,2-diol||dimension=Environmental > media=Water > water_body=Surface water; group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'87061-04-9': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-ad75f147419f6fdb: {'87061-04-9': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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