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Aconitine Crystalline
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Aconitine Crystalline
| Product Code | A8001-5MG |
|---|---|
| Unit of Measure | 1X5MG |
| CAS Number | 302-27-2 |
| MDL NUMBER | MFCD00082375 |
| EMPIRICAL FORMULA | C34H47NO11 |
| Molecular Weight | 645.74 |
| Synonyms | Acetylbenzoylaconine |
| Brand | SIGMA-ALDRICH |
Properties
| Property | Value |
|---|---|
| eCl@ss | 32160000 |
| Shipped on ICE | STD |
| UNSPSC Code | 12352200 |
| ADRSuff | A |
| CAS Number | 302-27-2 |
| ADR Hazard Labels | 6.1 |
| ADR Number of Danger | 66 |
| ADR Packing Group | 1 |
| ADR Primary Hazard Class | 6.1 |
| ADR Proper Shipping Name | Alkaloids, solid, n.o.s. |
| ADRNo | 1544 |
| EINECSNo | 206-121-7 |
| Flash Point | Not applicable |
| GHS Categories | Acute Tox. 2,Acute Tox. 3 |
| GHS Hazard Codes | H300-H331 |
| GHS Hazard Statements | Fatal if swallowed. Toxic if inhaled. |
| GHS Pictograms | GHS06 |
| GHS Precaution Codes | P261 - P301 + P330 + P331 + P310 - P304 + P340 + P311 - P403 + P233 |
| GHS Precaution Statements | Do not breathe dust/ fume/ gas/ mist/ vapours/ spray. Wash hands thoroughly after handling. Wear respiratory protection. Immediately call a POISON CENTER or doctor/ physician. |
| GHS Signal Words | Danger |
| Hazard Symbols | T+ |
| Hazard Symbols Descriptions | Very toxic |
| MDL Number | MFCD00082375 |
| Molecular Formula | C34H47NO11 |
| Molecular Weight | 645.74 |
| Net Weight | 5 |
| R-Phrases | 26/28 |
| RTECSNo | AR5960000 |
| S-Phrases | 24-45 |
| Synonyms | Acetylbenzoylaconine |
| Tariff Number | 29397990900 |
| Technical Name | ACONITINE |
| MSDS Link | https://www.sigmaaldrich.com/MSDS/MSDS/DisplayMSDSPage.do?country=DElanguage=ENproductNumber=A8001brand=SIGMA |
| Quality Level | 200 |
| Assay | >=95% (HPLC) |
| InChI | 1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21-,22-,23+,24+,25?,26?,27+,28-,29+,31+,32-,33?,34-/m1/s1 |
| solubility | H2O: 0.3 mg/mL |
| InChI key | XFSBVAOIAHNAPC-VBUFWTEXSA-N |
| SMILES string | CCN1C[C@]2(COC)[C@H](O)C[C@@H](OC)C34C5C[C@]6(O)[C@@H](OC)[C@H](O)[C@@](OC(C)=O)(C5[C@H]6OC(=O)c7ccccc7)C([C@H](OC)C23)C14 |
| color | white |
| form | crystalline |
Description
Aconitine Crystalline