116530-60-0
5-NITRO-2-INDANONE
Name
5-NITRO-2-INDANONE
Formula
C9 H7 N O3
MolWeight
177.158
1Identification
【Name】
5-NITRO-2-INDANONE
【CAS】
【MDL】
MFCD00598938
【English Synonyms】
【Formula】
C9 H7 N O3
【MolWeight】
177.158
【Inchi】
InChI=1S/C9H7NO3/c11-9-4-6-1-2-8(10(12)13)3-7(6)5-9/h1-3H,4-5H2
【InChIKey】
InChIKey=VSEBFWRYDORZJI-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1[N+](=O)[O-])CC(=O)C2
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
Chem-Impex International, Inc. :5-NITRO-2-INDANONE
4CML File
5-NITRO-2-INDANONE.cml
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