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| CAS No.: | 6101-15-1 |
|---|---|
| Name: | SUCCINYLCHOLINE CHLORIDE DIHYDRATE |
| Molecular Structure: | |
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| Formula: | C14H34Cl2N2O6 |
| Molecular Weight: | 397.3356 |
| Synonyms: | Choline,chloride, succinate (2:1), dihydrate (8CI);Ethanaminium,2,2'-[(1,4-dioxo-1,4-butanediyl)bis(oxy)]bis[N,N,N-trimethyl-, dichloride,dihydrate (9CI);Bis[2-(dimethylamino)ethyl] succinate bismethochloridedihydrate;Choline succinate dichloride dihydrate;Succinic acidbis(2-dimethylaminoethyl) ester, dimethochloride, dihydrate;Succinylcholinechloride dihydrate; |
| EINECS: | 200-747-4 |
| Density: | 1.31 g/cm3 |
| Melting Point: | 159-164 °C |
| Solubility: | H2O: unstable at pH > 9.soluble |
| Appearance: | White Solid |
| Hazard Symbols: | T |
| Risk Codes: | 25 |
| Safety: | 22-24/25 |
| PSA: | 71.06000 |
| LogP: | -5.85520 |
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Specification
The Ethanaminium,2,2'-[(1,4-dioxo-1,4-butanediyl)bis(oxy)]bis[N,N,N-trimethyl-, chloride,hydrate (1:2:2), with CAS registry number 6101-15-1, has the systematic name of 2,2'-[(1,4-dioxobutane-1,4-diyl)bis(oxy)]bis(N,N,N-trimethylethanaminium) chloride hydrate (1:2:2). This chemical is a kind of white solid. When use this chemical, do not breathe dust and avoid contact with skin and eyes. What's more, its EINECS is 200-747-4.
Physical properties of Ethanaminium,2,2'-[(1,4-dioxo-1,4-butanediyl)bis(oxy)]bis[N,N,N-trimethyl-, chloride,hydrate (1:2:2): (1)#H bond acceptors: 8; (2)#H bond donors: 4; (3)#Freely Rotating Bonds: 11; (4)Polar Surface Area: 71.06 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[Cl-].O=C(OCC[N+](C)(C)C)CCC(=O)OCC[N+](C)(C)C.O.O
(2)InChI: InChI=1/C14H30N2O4.2ClH.2H2O/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6;;;;/h7-12H2,1-6H3;2*1H;2*1H2/q+2;;;;/p-2
(3)InChIKey: FFSBEIRFVXGRPR-NUQVWONBAL
(4)Std. InChI: InChI=1S/C14H30N2O4.2ClH.2H2O/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6;;;;/h7-12H2,1-6H3;2*1H;2*1H2/q+2;;;;/p-2
(5)Std. InChIKey: FFSBEIRFVXGRPR-UHFFFAOYSA-L