648921-77-1
1,2,3,4-TETRAHYDRO-2-METHYL-1,4-METHANOISOQUINOLINE
Name1,2,3,4-TETRAHYDRO-2-METHYL-1,4-METHANOISOQUINOLINE
1Identification
【Name】
1,2,3,4-TETRAHYDRO-2-METHYL-1,4-METHANOISOQUINOLINE
【CAS】
【MDL】
MFCD13183948
【English Synonyms】
【Formula】
C11 H13 N
【MolWeight】
159.231
【Inchi】
InChI=1S/C11H13N/c1-12-7-8-6-11(12)10-5-3-2-4-9(8)10/h2-5,8,11H,6-7H2,1H3/t8-,11-/m0/s1
【InChIKey】
InChIKey=YXUJIRJOKPLNPC-KWQFWETISA-N
【SMILES】
CN1C[C@@H]2C[C@H]1c3c2cccc3
【MOL File】
1,2,3,4-TETRAHYDRO-2….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3,4-TETRAHYDRO-2-METHYL-1,4-METHANOISOQUINOLINE.cml