72989-10-7
DIHYDROQUINIDINE ACETATE
NameDIHYDROQUINIDINE ACETATE
1Identification
【Name】
DIHYDROQUINIDINE ACETATE
【CAS】
【MDL】
MFCD16876535
【English Synonyms】
【Formula】
C22 H28 N2 O3
【MolWeight】
368.474
【Inchi】
InChI=1S/C22H28N2O3/c1-4-15-13-24-10-8-16(15)11-21(24)22(27-14(2)25)18-7-9-23-20-6-5-17(26-3)12-19(18)20/h5-7,9,12,15-16,21-22H,4,8,10-11,13H2,1-3H3/t15-,16-,21+,22+/m1/s1
【InChIKey】
InChIKey=ZVEDOOXEZTUEBN-DJDZNOHASA-N
【SMILES】
CC[C@@H]1CN2CC[C@@H]1C[C@H]2[C@H](c3ccnc4c3cc(cc4)OC)OC(=O)C
【MOL File】
DIHYDROQUINIDINE ACE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIHYDROQUINIDINE ACETATE.cml