252061-87-3
1,4-DIHYDRO-6-PHENYLMETHOXY-3(2H)-ISOQUINOLINONE
Name1,4-DIHYDRO-6-PHENYLMETHOXY-3(2H)-ISOQUINOLINONE
1Identification
【Name】
1,4-DIHYDRO-6-PHENYLMETHOXY-3(2H)-ISOQUINOLINONE
【CAS】
【MDL】
MFCD03426206
【English Synonyms】
【Formula】
C16 H15 N O2
【MolWeight】
253.299
【Inchi】
InChI=1S/C16H15NO2/c18-16-9-14-8-15(7-6-13(14)10-17-16)19-11-12-4-2-1-3-5-12/h1-8H,9-11H2,(H,17,18)
【InChIKey】
InChIKey=FMWLMACQOCZCBD-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)COc2ccc3c(c2)CC(=O)NC3
【MOL File】
1,4-DIHYDRO-6-PHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIHYDRO-6-PHENYLMETHOXY-3(2H)-ISOQUINOLINONE.cml