543737-10-6
ISOQUINOLINE, 4-(3-BROMOPHENYL)-6,8-DICHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-
NameISOQUINOLINE, 4-(3-BROMOPHENYL)-6,8-DICHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-
1Identification
【Name】
ISOQUINOLINE, 4-(3-BROMOPHENYL)-6,8-DICHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-
【CAS】
【MDL】
MFCD22683909
【English Synonyms】
【Formula】
C16 H14 Br Cl2 N
【MolWeight】
371.104
【Inchi】
InChI=1S/C16H14BrCl2N/c1-20-8-14(10-3-2-4-11(17)5-10)13-6-12(18)7-16(19)15(13)9-20/h2-7,14H,8-9H2,1H3
【InChIKey】
InChIKey=LJCWTVCXFOSCRP-UHFFFAOYSA-N
【SMILES】
CN1Cc2c(cc(cc2Cl)Cl)C(C1)c3cccc(c3)Br
【MOL File】
ISOQUINOLINE, 4-(3-B….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:1
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ISOQUINOLINE, 4-(3-BROMOPHENYL)-6,8-DICHLORO-1,2,3,4-TETRAHYDRO-2-METHYL-.cml