2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl isothiocyanate
- Product Name2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl isothiocyanate
- CAS14152-97-7
- CBNumberCB7320022
- MFC15H19NO9S
- MW389.38
- MDL NumberMFCD00043085
- MOL File14152-97-7.mol
Chemical Properties
| Melting point: | 114-116 °C(lit.) |
| Boiling point: | 469.7±45.0 °C(Predicted) |
| Density | 1.40±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | Chloroform (Sparingly), Methanol (Slightly) |
| form | Solid |
| color | White to Off-White |
| BRN | 56699 |
| InChI | InChI=1/C15H19NO9S/c1-7(17)21-5-11-12(22-8(2)18)13(23-9(3)19)14(24-10(4)20)15(25-11)16-6-26/h11-15H,5H2,1-4H3/t11-,12-,13+,14-,15-/s3 |
| InChIKey | WOWNQYXIQWQJRJ-UUAXUISXNA-N |
| SMILES | [C@@H]1(OC(=O)C)[C@@H](OC(=O)C)[C@@H](O[C@H](COC(=O)C)[C@H]1OC(=O)C)N=C=S |&1:0,5,10,12,18,r| |
| CAS DataBase Reference | 14152-97-7(CAS DataBase Reference) |
Safety
| Symbol(GHS) |
  GHS07,GHS08 |
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| Signal word | Danger | |||||||||
| Hazard statements | H315-H317-H319-H334-H335 | |||||||||
| Precautionary statements | P280-P302+P352-P305+P351+P338 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | dust mask type N95 (US), Eyeshields, Faceshields, Gloves | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 36/37/38-42 | |||||||||
| Safety Statements | 22-26-36-45 | |||||||||
| RIDADR | 2810 | |||||||||
| WGK Germany | 3 | |||||||||
| F | 3-8-21 | |||||||||
| HS Code | 2938909090 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications |
Eye Irrit. 2 Resp. Sens. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |
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| NFPA 704: |
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