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4-nitroacetophenone

PropertiesImage
MNX_IDMNXM37657 Image of MNXM37657
referencechebi:28735
formulaC8H7NO3
global charge0
mol weight165.148
InChIKeyYQYGPGKTNQNXMH-UHFFFAOYSA-N
InChIInChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3
SMILESCC(=O)C1=CC=C([N+](=O)[O-])C=C1
MNX internals
InChI (mnx)InChI=1/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3 Image of MNXM37657
SMILES (mnx)[CH3:1][C:6]([C:7]1=[CH:3][CH:5]=[C:8]([N+:9]([O-:11])=[O:12])[CH:4]=[CH:2]1)=[O:10]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:28735
chebi:28735
YQYGPGKTNQNXMH-UHFFFAOYSA-N
4-nitroacetophenone
1-(4-nitrophenyl)ethanone
4'-Nitroacetophenone
4-Nitroacetophenone
4-nitrophenylacetoaldehyde
Methyl-p-nitrophenyl ketone
Paranitroacetophenone
p-Acetylnitrobenzene
p-Nitroacetophenone
p-Nitrophenyl methyl ketone
hmdb:HMDB0256052
YQYGPGKTNQNXMH-UHFFFAOYSA-N
4'-Nitroacetophenone
1-(4-nitrophenyl)ethan-1-one
4-Nitroacetophenone
4-Nitrophenylacetoaldehyde
Methyl-p-nitrophenyl ketone
PNAP
Paranitroacetophenone
p-Acetylnitrobenzene
p-Nitroacetophenone
p-Nitrophenyl methyl ketone

sabiork.compound:6351
sabiorkM:6351
kegg.compound:C02803
keggC:C02803
YQYGPGKTNQNXMH-UHFFFAOYSA-N
4-Nitroacetophenone
p-Nitroacetophenone

metacyc.compound:CPD-10547
metacycM:CPD-10547
YQYGPGKTNQNXMH-UHFFFAOYSA-N
4-nitroacetophenone
4'-nitroacetophenone
acetophenone, 4'-nitro-
ethanone, 1-(4-nitrophenyl)-
methyl-p-nitrophenyl ketone
p-acetylnitrobenzene
p-nitroacetophenone
p-nitrophenyl methyl ketone

seed.compound:cpd01812
seedM:cpd01812
YQYGPGKTNQNXMH-UHFFFAOYSA-N
p-Nitroacetophenone
4'-nitroacetophenone
4-Nitroacetophenone
4-nitroacetophenone
acetophenone, 4'-nitro-
ethanone, 1-(4-nitrophenyl)-
methyl-p-nitrophenyl ketone
p-acetylnitrobenzene
p-nitroacetophenone
p-nitrophenyl methyl ketone

chebi:1908
chebi:20454
keggC:M_C02803
seedM:M_cpd01812
secondary/obsolete/fantasy identifier