HIT ID: HIT106861714
Cas No: 14248-66-9
分子式: C7H8N2O3
分子量: 168.152
常用名: 3,5-Dimethyl-4-nitropyridine 1-oxide
常用名: 3,5-Dimethyl-4-nitropyridine 1-oxide
氢键受体数 (HBA): 3
氢键供体数 (HBD): 0
LogP: 0.46224344
IUPAC: 3,5-dimethyl-4-nitropyridin-1-ium-1-olate
IUPAC: 3,5-dimethyl-4-nitropyridin-1-ium-1-olate
SMILES: Cc1c[n+]([O-])cc(C)c1[N+]([O-])=O
SMILES: Cc1c[n+]([O-])cc(C)c1[N+]([O-])=O
InChI key: VLKVMXPKEDVNBO-UHFFFAOYSA-N