4-NITROISOQUINOLIN-1(2H)-ONE

CAS No.
55404-29-0
CCD No.
CCD00021860
Formula
C9 H6 N2 O3
MolWeight
190.157

Basic Information

Product Name: 4-NITROISOQUINOLIN-1(2H)-ONE
CAS: 55404-29-0
English Synonyms: 4-NITRO-1,2-DIHYDROISOQUINOLIN-1-ONE ; 4-NITRO-2H-ISOQUINOLIN-1-ONE ; 4-NITROISOQUINOLIN-1(2H)-ONE
MDL Number.: MFCD00030740
H bond acceptor: 5
H bond donor: 1
Smile: c1ccc2c(c1)c(c[nH]c2=O)[N+](=O)[O-]
InChi: InChI=1S/C9H6N2O3/c12-9-7-4-2-1-3-6(7)8(5-10-9)11(13)14/h1-5H,(H,10,12)
InChiKey: InChIKey=HBIRBNQMLAPWOH-UHFFFAOYSA-N

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