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3-chloro-1-phenyl-1-propanone

PropertiesImage
MNX_IDMNXM148644 Image of MNXM148644
referencechebi:232113
formulaC9H9ClO
global charge0
mol weight168.623
InChIKeyKTJRGPZVSKWRTJ-UHFFFAOYSA-N
InChIInChI=1S/C9H9ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2
SMILESO=C(CCCl)C1=CC=CC=C1
MNX internals
InChI (mnx)InChI=1/C9H9ClO/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5H,6-7H2 Image of MNXM148644
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:8]([C:9]([CH2:6][CH2:7][Cl:10])=[O:11])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-15523
metacycM:CPD-15523
seed.compound:cpd31669
seedM:cpd31669
CHEBI:232113
chebi:232113
KTJRGPZVSKWRTJ-UHFFFAOYSA-N
3-chloro-1-phenyl-1-propanone

seedM:M_cpd31669
secondary/obsolete/fantasy identifier