115017-61-3
(R)-5,6,6A,7-TETRAHYDRO-4H-DIBENZO[DE,G]QUINOLINE-10,11-DIOL HYDROBROMIDE
Name(R)-5,6,6A,7-TETRAHYDRO-4H-DIBENZO[DE,G]QUINOLINE-10,11-DIOL HYDROBROMIDE
FormulaC16 H15 N O2 . Br H
1Identification
【Name】
(R)-5,6,6A,7-TETRAHYDRO-4H-DIBENZO[DE,G]QUINOLINE-10,11-DIOL HYDROBROMIDE
【CAS】
【MDL】
MFCD00055170
【English Synonyms】
【Formula】
C16 H15 N O2 . Br H
【MolWeight】
334.211
【Inchi】
InChI=1S/C16H15NO2.BrH/c18-13-5-4-10-8-12-14-9(6-7-17-12)2-1-3-11(14)15(10)16(13)19;/h1-5,12,17-19H,6-8H2;1H/t12-;/m1./s1
【InChIKey】
InChIKey=SKTWZBLODKWJOU-UTONKHPSSA-N
【SMILES】
c1cc2c3c(c1)-c4c(ccc(c4O)O)C[C@H]3NCC2.Br
【MOL File】
(R)-5,6,6A,7-TETRAHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(R)-5,6,6A,7-TETRAHYDRO-4H-DIBENZO[DE,G]QUINOLINE-10,11-DIOL HYDROBROMIDE.cml