40431-54-7
2-METHYL-2,3,4,4A,5,9B-HEXAHYDRO-1H-PYRIDO-[4,3-B]INDOLE DIHYDROCHLORIDE
Name2-METHYL-2,3,4,4A,5,9B-HEXAHYDRO-1H-PYRIDO-[4,3-B]INDOLE DIHYDROCHLORIDE
FormulaC12 H16 N2 . 2 Cl H
1Identification
【Name】
2-METHYL-2,3,4,4A,5,9B-HEXAHYDRO-1H-PYRIDO-[4,3-B]INDOLE DIHYDROCHLORIDE
【CAS】
【MDL】
MFCD00454296
【English Synonyms】
【Formula】
C12 H16 N2 . 2 Cl H
【MolWeight】
261.194
【Inchi】
InChI=1S/C12H16N2.2ClH/c1-14-7-6-12-10(8-14)9-4-2-3-5-11(9)13-12;;/h2-5,10,12-13H,6-8H2,1H3;2*1H
【InChIKey】
InChIKey=UYOQLRWPQRXCPG-UHFFFAOYSA-N
【SMILES】
CN1CCC2C(C1)c3ccccc3N2.Cl.Cl
【MOL File】
2-METHYL-2,3,4,4A,5,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-2,3,4,4A,5,9B-HEXAHYDRO-1H-PYRIDO-[4,3-B]INDOLE DIHYDROCHLORIDE.cml