1745-06-8
1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-2-METHYLISOQUINOLINE, N-DE-ME
Name1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-2-METHYLISOQUINOLINE, N-DE-ME
1Identification
【Name】
1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-2-METHYLISOQUINOLINE, N-DE-ME
【CAS】
【MDL】
MFCD00835601
【English Synonyms】
【Formula】
C12 H17 N O3
【MolWeight】
223.27
【Inchi】
InChI=1S/C12H17NO3/c1-14-10-6-8-7-13-5-4-9(8)11(15-2)12(10)16-3/h6,13H,4-5,7H2,1-3H3
【InChIKey】
InChIKey=HMJWNMXNHQIAGT-UHFFFAOYSA-N
【SMILES】
COc1cc2c(c(c1OC)OC)CCNC2
【MOL File】
1,2,3,4-TETRAHYDRO-5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRAHYDRO-5,6,7-TRIMETHOXY-2-METHYLISOQUINOLINE, N-DE-ME.cml