566149-87-9
1,4-DIHYDRO-2,4-DIMETHYL-CYCLOPENT[B]INDOL-3(2H)-ONE
Name1,4-DIHYDRO-2,4-DIMETHYL-CYCLOPENT[B]INDOL-3(2H)-ONE
1Identification
【Name】
1,4-DIHYDRO-2,4-DIMETHYL-CYCLOPENT[B]INDOL-3(2H)-ONE
【CAS】
【MDL】
MFCD18836241
【English Synonyms】
【Formula】
C13 H13 N O
【MolWeight】
199.252
【Inchi】
InChI=1S/C13H13NO/c1-8-7-10-9-5-3-4-6-11(9)14(2)12(10)13(8)15/h3-6,8H,7H2,1-2H3
【InChIKey】
InChIKey=FKFYRCJRQYQMCZ-UHFFFAOYSA-N
【SMILES】
CC1Cc2c3ccccc3n(c2C1=O)C
【MOL File】
1,4-DIHYDRO-2,4-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-DIHYDRO-2,4-DIMETHYL-CYCLOPENT[B]INDOL-3(2H)-ONE.cml