37052-78-1
| Name | 5-Methoxy-2-mercaptobenzimidazole |
| CAS | 37052-78-1 |
| EINECS(EC#) | 253-326-2 |
| Molecular Formula | C8H8N2OS |
| MDL Number | MFCD00134581 |
| Molecular Weight | 180.23 |
| MOL File | 37052-78-1.mol |
Chemical Properties
| Appearance | off-white to light yellowish-brown powder |
| Melting point | 261-263 °C(lit.) |
| Boiling point | 309.4±44.0 °C(Predicted) |
| density | 1.2425 (rough estimate) |
| vapor pressure | 0.001Pa at 25℃ |
| refractive index | 1.5690 (estimate) |
| storage temp. | 2-8°C |
| solubility | DMSO (Slightly), Methanol (Sparingly) |
| form | Powder |
| pka | 10.13±0.30(Predicted) |
| color | Off-white to light yellow-brown |
| Water Solubility | insoluble |
| Sensitive | Air Sensitive |
| Detection Methods | HPLC,NMR |
| BRN | 3605123 |
| InChI | 1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12) |
| InChIKey | KOFBRZWVWJCLGM-UHFFFAOYSA-N |
| SMILES | COc1ccc2[nH]c(S)nc2c1 |
| LogP | 1.52-2.399 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P305+P351+P338 |
| Hazard Codes | Xi,Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Hazard Note | Irritant |
| REACH Registrations | Active |
| HazardClass | IRRITANT |
| HS Code | 29339900 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral Aquatic Chronic 3 Skin Sens. 1 |