2-Methyl-3-furanthiol
- Product Name2-Methyl-3-furanthiol
- CAS28588-74-1
- CBNumberCB7380338
- MFC5H6OS
- MW114.17
- EINECS249-094-7
- MDL NumberMFCD00010280
- MOL File28588-74-1.mol
Chemical Properties
| Boiling point: | 57-60 °C/44 mmHg (lit.) |
| Density | 1.145 g/mL at 25 °C |
| vapor density | >1 (vs air) |
| refractive index | n |
| FEMA | 3188 | 2-METHYL-3-FURANTHIOL |
| Flash point: | 98 °F |
| storage temp. | Inert atmosphere,2-8°C |
| solubility | soluble in Chloroform, Methanol |
| pka | 6.32±0.48(Predicted) |
| form | Liquid |
| Specific Gravity | 1.145 |
| color | Clear to hazy light pink to light orange |
| Odor | roast beef aroma |
| Odor Type | sulfurous |
| biological source | synthetic |
| JECFA Number | 1060 |
| Major Application | flavors and fragrances |
| Cosmetics Ingredients Functions | PERFUMING |
| InChI | 1S/C5H6OS/c1-4-5(7)2-3-6-4/h2-3,7H,1H3 |
| InChIKey | RUYNUXHHUVUINQ-UHFFFAOYSA-N |
| SMILES | Cc1occc1S |
| LogP | 2.14 |
| CAS DataBase Reference | 28588-74-1(CAS DataBase Reference) |
| NIST Chemistry Reference | 2-Methyl-3-furanthiol(28588-74-1) |
| EPA Substance Registry System | 3-Furanthiol, 2-methyl- (28588-74-1) |
Safety
| Symbol(GHS) |
  GHS02,GHS06 |
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| Signal word | Danger | |||||||||
| Hazard statements | H226-H301 | |||||||||
| Precautionary statements | P210-P301+P310+P330 | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter | |||||||||
| Hazard Codes | T,T+ | |||||||||
| Risk Statements | 10-25-36-26-2017/10/25 | |||||||||
| Safety Statements | 16-45-39-38-28-26 | |||||||||
| RIDADR | UN 1228 3/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | LU6235000 | |||||||||
| TSCA | TSCA listed | |||||||||
| HazardClass | 3.2 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 2932190090 | |||||||||
| Storage Class | 3 - Flammable liquids | |||||||||
| Hazard Classifications |
Acute Tox. 3 Oral Flam. Liq. 3 |
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| Toxicity | mouse,LD50,oral,100mg/kg (100mg/kg),Drug and Chemical Toxicology. Vol. 3, Pg. 249, 1980. | |||||||||
| Limited Quantities | 5.0 L (1.3 gallons) (liquid) | |||||||||
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L) | |||||||||
| NFPA 704: |
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