58878-84-5
5-BROMO-1-(PIPERIDIN-4-YL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE HYDROCHLORIDE
Name5-BROMO-1-(PIPERIDIN-4-YL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE HYDROCHLORIDE
FormulaC12 H14 Br N3 O . Cl H
1Identification
【Name】
5-BROMO-1-(PIPERIDIN-4-YL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE HYDROCHLORIDE
【CAS】
【MDL】
MFCD16621681
【English Synonyms】
【Formula】
C12 H14 Br N3 O . Cl H
【MolWeight】
332.628
【Inchi】
InChI=1S/C12H14BrN3O.ClH/c13-8-1-2-11-10(7-8)15-12(17)16(11)9-3-5-14-6-4-9;/h1-2,7,9,14H,3-6H2,(H,15,17);1H
【InChIKey】
InChIKey=RYETYOFPXYOAIX-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1Br)[nH]c(=O)n2C3CCNCC3.Cl
【MOL File】
5-BROMO-1-(PIPERIDIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-BROMO-1-(PIPERIDIN-4-YL)-1H-BENZO[D]IMIDAZOL-2(3H)-ONE HYDROCHLORIDE.cml