DEDITONIUM BROMIDE

CAS No.
2401-56-1
CCD No.
CCD00177173
Formula
C38 H66 N2 O2 . 2 Br
MolWeight
742.759

Basic Information

Product Name: DEDITONIUM BROMIDE
CAS: 2401-56-1
English Synonyms: DEDITONIUM BROMIDE
MDL Number.: MFCD00868875
H bond acceptor: 4
H bond donor: 0
Smile: Cc1ccc(c(c1)OCC[N+](C)(C)CCCCCCCCCC[N+](C)(C)CCOc2cc(ccc2C(C)C)C)C(C)C.[Br-].[Br-]
InChi: InChI=1S/C38H66N2O2.2BrH/c1-31(2)35-21-19-33(5)29-37(35)41-27-25-39(7,8)23-17-15-13-11-12-14-16-18-24-40(9,10)26-28-42-38-30-34(6)20-22-36(38)32(3)4;;/h19-22,29-32H,11-18,23-28H2,1-10H3;2*1H/q+2;;/p-2
InChiKey: InChIKey=KRJLZXUYKFHTSN-UHFFFAOYSA-L

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