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pentane-2,3-dione

PropertiesImage
MNX_IDMNXM73203 Image of MNXM73203
referencechebi:52774
formulaC5H8O2
global charge0
mol weight100.117
InChIKeyTZMFJUDUGYTVRY-UHFFFAOYSA-N
InChIInChI=1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3
SMILESCCC(=O)C(C)=O
MNX internals
InChI (mnx)InChI=1/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3 Image of MNXM73203
SMILES (mnx)[CH3:1][CH2:3][C:5]([C:4]([CH3:2])=[O:6])=[O:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:52774
chebi:52774
TZMFJUDUGYTVRY-UHFFFAOYSA-N 		pentane-2,3-dione
2,3-Pentanedione
Acetyl propionyl
Acetylpropionyl
ethyl methyl diketone

sabiork.compound:23137
sabiorkM:23137
TZMFJUDUGYTVRY-UHFFFAOYSA-N 		2,3-Pentanedione
hmdb:HMDB0031598
TZMFJUDUGYTVRY-UHFFFAOYSA-N 		2,3-Pentanedione
2,3-Pentadione
2,3-Pentandione
2,3-Pentane-dione
23-PENTANEDIONE
Acetyl propionyl
Acetylpropionyl
Benzil-related compound, 43
CH3C(O)C(O)C2H5
Ethyl methyl diketone
FEMA 2841
Pentan-2,3-dione
Pentane-2,3-dione
acetyl propionyl
pentane-2,3-dione

metacyc.compound:23-PENTANEDIONE
metacycM:23-PENTANEDIONE
seed.compound:cpd21927
seedM:cpd21927
TZMFJUDUGYTVRY-UHFFFAOYSA-N 		2,3-pentane-dione

envipath:...7627a374483b
envipathM:...7627a374483b
TZMFJUDUGYTVRY-UHFFFAOYSA-N 		compound 0072421

hmdb:HMDB31598
seedM:M_cpd21927 		secondary/obsolete/fantasy identifier