6700-34-1
| Name | Dextromethorphan hydrobromide monohydrate |
| CAS | 6700-34-1 |
| EINECS(EC#) | 629-741-3 |
| Molecular Formula | C18H28BrNO2 |
| MDL Number | MFCD02173901 |
| Molecular Weight | 370.32 |
| MOL File | 6700-34-1.mol |
Chemical Properties
| Appearance | White Solid |
| Melting point | 116-119°C |
| alpha | [α]D25 +26～+30° (c=1.85, H2O) |
| Fp | 11 °C |
| storage temp. | Store at RT |
| solubility | Sparingly soluble in water, freely soluble in ethanol (96 per cent). |
| form | solid |
| color | White to Off-White |
| PH | pH (10g/l, 25℃) : 5.2～6.5 |
| Usage | An antitussive drug |
| BRN | 6453793 |
| InChI | InChI=1/C18H25NO.BrH.H2O/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18;;/h6-7,12,15,17H,3-5,8-11H2,1-2H3;1H;1H2/t15-,17+,18+;;/s3 |
| InChIKey | QYPSYPPSHXDFLV-UHFFFAOYSA-N |
| SMILES | O(C1C=CC2C[C@]3([H])N(C)CC[C@]4(CCCC[C@@]43[H])C=2C=1)C.Br.O |&1:6,12,17,r| |
| LogP | 1.351 (est) |
| CAS DataBase Reference | 6700-34-1(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |   GHS06,GHS09 |
| Signal word | Danger |
| Hazard statements | H301-H411 |
| Precautionary statements | P264-P270-P273-P301+P310-P391-P405 |
| Hazard Codes | F,T |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 3822000002 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Aquatic Chronic 2 |