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Succinylcholine Chloride
CAS: 71-27-2 | C14H30Cl2N2O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
71-27-2
Molecular Formula:
C14H30Cl2N2O4
Molecular Mass:
361.31 g/mol
Names and Synonyms:
Succinylcholine Chloride
Ethanaminium, 2,2′-[(1,4-dioxo-1,4-butanediyl)bis(oxy)]bis[N,N,N-trimethyl-, chloride (1:2)
Choline, chloride succinate
Choline, chloride, succinate (2:1)
Ethanaminium, 2,2′-[(1,4-dioxo-1,4-butanediyl)bis(oxy)]bis[N,N,N-trimethyl-, dichloride
Succinic acid, diester with choline chloride
Anectine chloride
Bis(2-dimethylaminoethyl) succinate bis(methochloride)
Choline succinate dichloride
2-Dimethylaminoethyl succinate dimethochloride
(2-Hydroxyethyl)trimethylammonium chloride succinate
Lysthenon
Lysthenone
Midarine
Quelicin chloride
Scoline chloride
Succicuran
Succinic acid bis[β-dimethylaminoethyl] ester dimethochloride
Succinoylcholine chloride
Succinyl-asta
Succinyl bischoline chloride
Succinylcholine chloride
Succinylcholine dichloride
Succinyldicholine chloride
Succinylforte
Sucostrin chloride
Suxamethonium chloride
Anectine
Succinylbischoline dichloride
Scoline
Suxamethonium dichloride
Quelicin
Skolin
Pantolax
Myoplegine
Succin
Sukolin
Sucostrin
Diacetylcholine dichloride
Querlicin
Succinolin
Identifiers:
SMILES:
C[N+](C)(C)CCOC(=O)CCC(=O)OCC[N+](C)(C)C.[Cl-].[Cl-]
InChI:
InChI=1S/C14H30N2O4.2ClH/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/q+2;;/p-2
Key Properties
Melting Point
190 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 361.31 g/mol | CAS Common Chemistry |
| 361.30999999999995 g/mol | RDKit | |
| 360.1582628 g/mol | RDKit | |
| Canonical SMILES | [Cl-].O=C(OCC[N+](C)(C)C)CCC(=O)OCC[N+](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C14H30N2O4.2ClH/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/q+2;;/p-2 | CAS Common Chemistry |
| InChI Key | InChIKey=YOEWQQVKRJEPAE-UHFFFAOYSA-L | CAS Common Chemistry |
| Melting Point | 190 °C | CAS Common Chemistry |
| Name | Succinylcholine chloride | CAS Common Chemistry |
| Heavy Atom Count | 22 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 9 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 52.60000000000001 Ų | RDKit |
| LogP | -5.726600000000004 | RDKit |
| Molar Refractivity | 76.95080000000006 | RDKit |
