2,6-DIMETHYLTHIOPHENOL CAS 118-72-9
Introduction：Basic information about 2,6-DIMETHYLTHIOPHENOL CAS 118-72-9, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
2,6-DIMETHYLTHIOPHENOL Basic informationDescription
| Product Name: | 2,6-DIMETHYLTHIOPHENOL |
| Synonyms: | Vortioxetine Impurity 44;O-Toluenethiol 2,6-Dimethyl benzenethiol;2,6-DIMETHYLBENZENETHIOL;2,6-DIMETHYLTHIOPHENOL;FEMA 3666;2,6-dimethyl-benzenethio;2 6-DIMETHYLTHIOPHENOL 95+%;2,6-Dimethylbenzolthiol |
| CAS: | 118-72-9 |
| MF: | C8H10S |
| MW: | 138.23 |
| EINECS: | 204-272-3 |
| Product Categories: | Bioactive Small Molecules;Building Blocks;Cell Biology;Chemical Synthesis;DIG-DY;Organic Building Blocks;Sulfur Compounds;Thiols/Mercaptans |
| Mol File: | 118-72-9.mol |
2,6-DIMETHYLTHIOPHENOL Chemical Properties
| Melting point | -30°C (estimate) |
| Boiling point | 122 °C50 mm Hg |
| density | 1.038 g/mL at 25 °C |
| FEMA | 3666 | 2,6-DIMETHYLTHIOPHENOL |
| refractive index | n |
| Fp | 186 °F |
| storage temp. | Inert atmosphere,Room Temperature |
| pka | 7.03±0.50(Predicted) |
| form | liquid |
| color | Clear |
| Specific Gravity | 1.038 |
| Odor | at 0.10 % in propylene glycol. sulfury meaty roasted phenolic metallic |
| Odor Type | sulfurous |
| biological source | synthetic |
| Sensitive | Moisture Sensitive |
| JECFA Number | 530 |
| BRN | 1099405 |
| InChI | 1S/C8H10S/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3 |
| InChIKey | QCLJODDRBGKIRW-UHFFFAOYSA-N |
| SMILES | Cc1cccc(C)c1S |
| LogP | 3.15 |
| CAS DataBase Reference | 118-72-9(CAS DataBase Reference) |
| EPA Substance Registry System | Benzenethiol, 2,6-dimethyl- (118-72-9) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37/39-36-7/9 |
| RIDADR | UN 3334 |
| WGK Germany | 2 |
| TSCA | TSCA listed |
| HazardClass | 6.1 |
| HazardClass | IRRITANT, STENCH |
| HS Code | 29309090 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Description | 2,6-Dimethylbenzenethiol, also known as 2,6-dimethyl thiophenol or 2,6-xylenethiol, the molecular formula is C8H10S, which belongs to the class of organic compounds known as thiophenols. Thiophenols are compounds containing a thiophenol ring, which a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur atom. 2,6-Dimethylbenzenethiol is a very weakly acidic compound (based on its pKa). 2,6-Dimethylbenzenethiol is a meaty, metallic, and phenolic tasting compound. |
| Chemical Properties | clear colorless to light yellow liquid |
| Chemical Properties | 2,6-Dimethylthiophenol has a strong odor. |
| Occurrence | Reported found in boiled beef |
| Uses | 2,6-Dimethylbenzenethiol was used in the synthesis of (2,6-Me2C6H3S)2Pb by reacting with Pb(OAc)2. |
| Taste threshold values | Meaty, vegetative and nutty with a slight sulfuraceous nuance. |
2,6-DIMETHYLTHIOPHENOL Preparation Products And Raw materials
