This chemical is called 3,3'-(1,2-Ethanediylbis(dimethylsilylene))bis(N,N,N-trimethyl-1-propanaminium) diiodide, and it can also be named as N,N'-(4,4,7,7-Tetramethyl-4,7-disiladecamethylen)bis(trimethylammoniumiodid). With the molecular formula of C18H46N2Si2•2I, its molecular weight is 600.55. The CAS registry number of this chemical is 76615-66-2, and its classification code is Organometallic.
Other characteristics of the 3,3'-(1,2-Ethanediylbis(dimethylsilylene))bis(N,N,N-trimethyl-1-propanaminium) diiodide can be summarised as followings: (1)ACD/LogP: -1.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.21; (4)ACD/LogD (pH 7.4): -1.21; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.21; (8)ACD/KOC (pH 7.4): 5.21; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 0 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: [I-].[I-].C(C[Si](CC[Si](C)(CCC[N+](C)(C)C)C)(C)C)C[N+](C)(C)C
2.InChI: InChI=1/C18H46N2Si2.2HI/c1-19(2,3)13-11-15-21(7,8)17-18-22(9,10)16-12-14-20(4,5)6;;/h11-18H2,1-10H3;2*1H/q+2;;/p-2
3.InChIKey: ZGKSFTWAVPERAG-NUQVWONBAX
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 420ug/kg (0.42mg/kg) | Liebigs Annalen der Chemie. Vol. (11), Pg. 1859, |
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