803644-07-7
2,9-DIHYDRO-4-HYDROXY-2,9-DIMETHYL-3H-PYRIDO[3,4-B]INDOL-3-ONE
Name
2,9-DIHYDRO-4-HYDROXY-2,9-DIMETHYL-3H-PYRIDO[3,4-B]INDOL-3-ONE
Formula
C13 H12 N2 O2
MolWeight
228.25
1Identification
【Name】
2,9-DIHYDRO-4-HYDROXY-2,9-DIMETHYL-3H-PYRIDO[3,4-B]INDOL-3-ONE
【CAS】
【MDL】
MFCD18818408
【English Synonyms】
【Formula】
C13 H12 N2 O2
【MolWeight】
228.25
【Inchi】
InChI=1S/C13H12N2O2/c1-14-7-10-11(12(16)13(14)17)8-5-3-4-6-9(8)15(10)2/h3-7,16H,1-2H3
【InChIKey】
InChIKey=NCXSNRMJXFNJGO-UHFFFAOYSA-N
【SMILES】
Cn1cc2c(c3ccccc3n2C)c(c1=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,9-DIHYDRO-4-HYDROXY-2,9-DIMETHYL-3H-PYRIDO[3,4-B]INDOL-3-ONE.cml
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