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3-hexanone

UUID 0d7a620c-6556-11dd-ad8b-0800200c9a66
Flow Object IDfo-560eeae13e799131
Source EF 3.1
Context Environmental → Water → Surface water
CAS Numbers 589-38-8
EC Numbers 209-645-4
prefLabel
Language Value Provenance
en 3-hexanone
altLabel
Language Value Provenance
en 3-Oxohexane
en Ethyl n-propyl ketone
en Ethyl propyl ketone
en hexan-3-one
Definitions
Language Value Provenance
en A dialkyl ketone that is hexane in which the two methylene protons at position 3 have been replaced by an oxo group.
References
Shared Properties
Predicate Value
Formal charge 0
InChIKey PFCHFHIRKBAQGU-UHFFFAOYSA-N
InChI InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3
IUPAC name 3-hexanone, hexan-3-one
Molecular formula C6H12O
Molecular mass 100.161
Monoisotopic mass 100.08882
SMILES CCCC(=O)CC

Source List References

List Version Source Flow UUID Source Flow Name
EF 3.1 0d7a620c-6556-11dd-ad8b-0800200c9a66 3-hexanone

Concept Associations

Source List Source Flow Source Context Unit Match Type Conversion Provenance
EF 3.1 3-hexanone 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
cas_match_labels 1 — consensus_match group_key=3-hexanone||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'589-38-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-560eeae13e799131: {'589-38-8': 'exactMatch'}

Context Attributes

AttributeValue
dimensionEnvironmental
mediaWater
water_bodySurface water

Consensus Changes

Field Old Value New Value Comment
cas_match_labels None {'589-38-8': 'exactMatch'} group_key=3-hexanone||dimension=Environmental > media=Air > strata=Ground level > population_density=Rural (<1000 people/square mile); group_sources=['chebi', 'ec_inventory', 'pubchem']; cas_sources={'589-38-8': ['chebi', 'ec_inventory', 'pubchem']}; assigned CAS labels from group consensus; object_uuid=fo-560eeae13e799131: {'589-38-8': 'exactMatch'}

PROV-O Consensus Activity Trail

No PROV-O consensus activities found for this flow.

Full Flow JSON

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