305370-83-6
1,4-DIHYDRO-6-NITRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBONITRILE
Name1,4-DIHYDRO-6-NITRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBONITRILE
1Identification
【Name】
1,4-DIHYDRO-6-NITRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBONITRILE
【CAS】
【MDL】
MFCD11559010
【English Synonyms】
【Formula】
C9 H4 N4 O3
【MolWeight】
216.156
【Inchi】
InChI=1S/C9H4N4O3/c10-2-5-3-11-9-7(8(5)14)1-6(4-12-9)13(15)16/h1,3-4H,(H,11,12,14)
【InChIKey】
InChIKey=RWDPPUXFHFMJCN-UHFFFAOYSA-N
【SMILES】
c1c(cnc2c1c(=O)c(c[nH]2)C#N)[N+](=O)[O-]
【MOL File】
1,4-DIHYDRO-6-NITRO-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIHYDRO-6-NITRO-4-OXO-1,8-NAPHTHYRIDINE-3-CARBONITRILE.cml