778522-84-2
1,2,3,4-TETRAHYDRO-5,7-DIMETHYL-9H-PYRROLO[3,4-B]QUINOLIN-9-ONE
Name1,2,3,4-TETRAHYDRO-5,7-DIMETHYL-9H-PYRROLO[3,4-B]QUINOLIN-9-ONE
1Identification
【Name】
1,2,3,4-TETRAHYDRO-5,7-DIMETHYL-9H-PYRROLO[3,4-B]QUINOLIN-9-ONE
【CAS】
【MDL】
MFCD18823221
【English Synonyms】
【Formula】
C13 H14 N2 O
【MolWeight】
214.267
【Inchi】
InChI=1S/C13H14N2O/c1-7-3-8(2)12-9(4-7)13(16)10-5-14-6-11(10)15-12/h3-4,14H,5-6H2,1-2H3,(H,15,16)
【InChIKey】
InChIKey=ZVIZUDRORLEJFU-UHFFFAOYSA-N
【SMILES】
Cc1cc(c2c(c1)c(=O)c3c([nH]2)CNC3)C
【MOL File】
1,2,3,4-TETRAHYDRO-5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRAHYDRO-5,7-DIMETHYL-9H-PYRROLO[3,4-B]QUINOLIN-9-ONE.cml