553-28-6
3,4-DIHYDRO-6,7-DIMETHOXY-2-METHYLISOQUINOLINIUM CHLORIDE
Name3,4-DIHYDRO-6,7-DIMETHOXY-2-METHYLISOQUINOLINIUM CHLORIDE
1Identification
【Name】
3,4-DIHYDRO-6,7-DIMETHOXY-2-METHYLISOQUINOLINIUM CHLORIDE
【CAS】
【MDL】
MFCD01717087
【English Synonyms】
【Formula】
C12 H16 N O2 . Cl
【MolWeight】
241.716
【Inchi】
InChI=1S/C12H16NO2.ClH/c1-13-5-4-9-6-11(14-2)12(15-3)7-10(9)8-13;/h6-8H,4-5H2,1-3H3;1H/q+1;/p-1
【InChIKey】
InChIKey=SNESGMZASZVGNN-UHFFFAOYSA-M
【SMILES】
C[N+]1=Cc2cc(c(cc2CC1)OC)OC.[Cl-]
【MOL File】
3,4-DIHYDRO-6,7-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,4-DIHYDRO-6,7-DIMETHOXY-2-METHYLISOQUINOLINIUM CHLORIDE.cml