90-39-1
| Name | (-)-SPARTEINE |
| CAS | 90-39-1 |
| EINECS(EC#) | 201-988-8 |
| Molecular Formula | C15H26N2 |
| MDL Number | MFCD00069653 |
| Molecular Weight | 234.38 |
| MOL File | 90-39-1.mol |
Chemical Properties
| Melting point | 30.5°C |
| alpha | D21 -16.4° (c = 10 in abs alc) |
| Boiling point | 137-138 °C1 mm Hg(lit.) |
| density | 1.02 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | >230 °F |
| storage temp. | 2-8°C |
| solubility | Chloroform (Slightly), Ethanol (Slightly) |
| form | liquid |
| pka | 2.24, 9.46(at 20℃) |
| color | Light Yellow to Yellow |
| Optical Rotation | [α]/D -17.5±1.5°, c = 1 in ethanol |
| Water Solubility | 3.04g/L(25 ºC) |
| Merck | 14,8737 |
| BRN | 82447 |
| InChI | 1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2/t12-,13-,14-,15+/m0/s1 |
| InChIKey | SLRCCWJSBJZJBV-ZQDZILKHSA-N |
| SMILES | C1CCN2C[C@@H]3C[C@@H](CN4CCCC[C@H]34)[C@@H]2C1 |
| LogP | 3.210 (est) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H302+H312+H332 |
| Precautionary statements | P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312 |
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 3140 |
| WGK Germany | 3 |
| RTECS | WG5950000 |
| HazardClass | 6.1(b) |
| PackingGroup | III |
| HS Code | 2933399990 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral |