Basic information
- Name:
(-)-Sparteine sulfate pentahydrate
- CAS No.:
6160-12-9
- Molecular Structure:
- Formula:
- C15H26N2.H2SO4.5(H2O)
- Molecular Weight:
- 422.54
- Synonyms:
- Sparteine sulfate [USAN:JAN];Sparteine sulfate pentahydrate;Sparteinum sulfuricum;Sparteine sulfate (1:1) pentahydrate;7,14-Methano-2H,6H-dipyrido(1,2-a:1,2-e)(1,5)diazocine, dodecahydro-, (7S-(7alpha,7aalpha,14alpha,14abeta))-, sulfate (1:1), pentahydrate;Sparteine sulfate (JAN/USAN);L-Spartein sulfate-5-wasser;
- EINECS:
- 206-078-4
- Melting Point:
- 133-140 °C(lit.)
- Boiling Point:
- 791 °C at 760 mmHg
- Flash Point:
- 432.2 °C
- Solubility:
- water: 0.1 g/mL, clear, colorless
- Appearance:
- white fine crystalline powder
- Hazard Symbols:
Xn- Risk Codes:
- 22-20/21/22
- Safety Description:
- 36-24/25 Details
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Chemistry
Molecular Structure of (-)-Sparteine sulfate pentahydrate (CAS NO. 6160-12-9):
EINECS: 206-078-4
Systematic Name: Sparteine sulfate pentahydrate
Molecular Formula: C15H38N2O9S
Molecular Weight: 422.535220 g/mol
H-Bond Donor: 7
H-Bond Acceptor: 11
Isomeric SMILES: C1CCN2C[C@H]3C[C@@H]([C@H]2C1)CN4[C@H]3CCCC4.O.O.O.O.O.OS(=O)(=O)O
InChI: InChI=1S/C15H26N2.H2O4S.5H2O/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17;1-5(2,3)4;;;;;/h12-15H,1-11H2; H2,1,2,3,4);5*1H2/t12-,13-,14-,15+;;;;;;/m1....../s1
InChIKey: WNSDDGBLIALDPB-HTZKOJAYSA-N
Flash Point: 148.3 °C
Enthalpy of Vaporization: 58.45 kJ/mol
Boiling Point: 340.9 °C at 760 mmHg
Vapour Pressure: 8.34E-05 mmHg at 25 °C
Melting Point: 133-140 °C(lit.)
Water Solubility: 0.1 g/mL, clear, colorless
Refractive Index: -22 ° (C=5, H2O)
Alpha: -28 º (589nm, c=2, H2O 25 ºC)
Storage Temp.: 2-8 °C
Product Categories: Alkaloids; Alkaloids (Others); Biochemistry
Safety Profile
Safety Information of (-)-Sparteine sulfate pentahydrate (CAS NO. 6160-12-9):
Hazard Codes: Xn 
Risk Statements: 22-20/21/22
R22:Harmful if swallowed
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed
Safety Statements: 36-24/25
S36:Wear suitable protective clothing
S24/25:Avoid contact with skin and eyes
WGK Germany: 3
RTECS: WG6430000
Specification
(-)-Sparteine sulfate pentahydrate with cas registry number of 6160-12-9 is also known as Sparteine sulfate [USAN:JAN] ; Sparteine sulfate pentahydrate ; 7,14-Methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocine, dodecahydro-, (7S-(7alpha,7aalpha,14alpha,14abeta))-, sulfate (1:1), pentahydrate ; L-Spartein sulfate-5-wasser ; Sparteine sulfate (1:1) pentahydrate ; Sparteinum sulfuricum . It is white fine crystalline powder.
