74122-83-1
1,2,3,4,5,8-HEXAHYDRO-7-METHOXY-1-METHYL-ISOQUINOLINE
Name1,2,3,4,5,8-HEXAHYDRO-7-METHOXY-1-METHYL-ISOQUINOLINE
1Identification
【Name】
1,2,3,4,5,8-HEXAHYDRO-7-METHOXY-1-METHYL-ISOQUINOLINE
【CAS】
【MDL】
MFCD13179569
【English Synonyms】
【Formula】
C11 H17 N O
【MolWeight】
179.261
【Inchi】
InChI=1S/C11H17NO/c1-8-11-7-10(13-2)4-3-9(11)5-6-12-8/h4,8,12H,3,5-7H2,1-2H3
【InChIKey】
InChIKey=DVSYHCWGRNXXPX-UHFFFAOYSA-N
【SMILES】
CC1C2=C(CCN1)CC=C(C2)OC
【MOL File】
1,2,3,4,5,8-HEXAHYDR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4,5,8-HEXAHYDRO-7-METHOXY-1-METHYL-ISOQUINOLINE.cml