697801-48-2
1,4-DIHYDRO-8-HYDROXY-3(2H)-ISOQUINOLINONE
Name1,4-DIHYDRO-8-HYDROXY-3(2H)-ISOQUINOLINONE
1Identification
【Name】
1,4-DIHYDRO-8-HYDROXY-3(2H)-ISOQUINOLINONE
【CAS】
【MDL】
MFCD13179160
【English Synonyms】
【Formula】
C9 H9 N O2
【MolWeight】
163.175
【Inchi】
InChI=1S/C9H9NO2/c11-8-3-1-2-6-4-9(12)10-5-7(6)8/h1-3,11H,4-5H2,(H,10,12)
【InChIKey】
InChIKey=FPNXUGAWBUFHGM-UHFFFAOYSA-N
【SMILES】
c1cc2c(c(c1)O)CNC(=O)C2
【MOL File】
1,4-DIHYDRO-8-HYDROX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIHYDRO-8-HYDROXY-3(2H)-ISOQUINOLINONE.cml