HIT ID: HIT100419729
Cas No: 19037-69-5
分子式: C10H7NO5
分子量: 221.168
常用名: 7-hydroxy-4-methyl-8-nitrocoumarin
常用名: 7-hydroxy-4-methyl-8-nitrocoumarin
氢键受体数 (HBA): 5
氢键供体数 (HBD): 1
LogP: 2.01
IUPAC: 7-hydroxy-4-methyl-8-nitro-2H-chromen-2-one
IUPAC: 7-hydroxy-4-methyl-8-nitro-2H-chromen-2-one
SMILES: Cc1cc(=O)oc2c(c(O)ccc12)[N+]([O-])=O
SMILES: Cc1cc(=O)oc2c(c(O)ccc12)[N+]([O-])=O
InChI key: BGUBUSIGKOWDPO-UHFFFAOYSA-N