loading...| Preferred Name |
acetone |
|
| Synonyms |
Acetone acetone propan-2-one ACETONE Dimethyl ketone Propanon 2-Propanone Azeton Dimethylketon propanone Aceton Pyroacetic ether methyl ketone beta-Ketopropane dimethylcetone dimethylketone |
|
| Definitions |
A methyl ketone that consists of propane bearing an oxo group at C2. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_15347 |
|
| charge |
0 |
|
| database_cross_reference |
KEGG:C00207 Beilstein:635680 LIPID_MAPS_instance:LMFA12000057 PDBeChem:ACN CAS:67-64-1 KEGG:D02311 MetaCyc:ACETONE Gmelin:1466 Wikipedia:Acetone Reaxys:635680 PMID:17347819 PMID:17190852 HMDB:HMDB0001659 UM-BBD_compID:c0556 |
|
| definition |
A methyl ketone that consists of propane bearing an oxo group at C2. |
|
| formula |
C3H6O |
|
| has_alternative_id |
CHEBI:40571 CHEBI:13708 CHEBI:22182 CHEBI:2398 |
|
| has_exact_synonym |
Acetone acetone propan-2-one ACETONE |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Dimethyl ketone Propanon 2-Propanone Azeton Dimethylketon propanone Aceton Pyroacetic ether methyl ketone beta-Ketopropane dimethylcetone dimethylketone |
|
| id |
CHEBI:15347 |
|
| in_subset | ||
| inchi |
InChI=1S/C3H6O/c1-3(2)4/h1-2H3 |
|
| inchikey |
CSCPPACGZOOCGX-UHFFFAOYSA-N |
|
| label |
acetone |
|
| mass |
58.07914 |
|
| monoisotopicmass |
58.04186 |
|
| notation |
CHEBI:15347 |
|
| prefLabel |
acetone |
|
| smiles |
CC(C)=O |
|
| subClassOf |