NEOPENTYL ALCOHOL
- Product NameNEOPENTYL ALCOHOL
- CAS75-84-3
- CBNumberCB5315323
- MFC5H12O
- MW88.15
- EINECS200-907-3
- MDL NumberMFCD00004682
- MOL File75-84-3.mol
Chemical Properties
| Melting point: | 52-56 °C(lit.) |
| Boiling point: | 113-114 °C(lit.) |
| Density | 0.818 g/mL at 25 °C(lit.) |
| vapor pressure | 16 mm Hg ( 20 °C) |
| refractive index | 1.3915 |
| Flash point: | 98 °F |
| storage temp. | Flammables area |
| form | Waxy Crystalline Solid |
| pka | 15.24±0.10(Predicted) |
| Specific Gravity | 0.818 |
| color | Colorless |
| Water Solubility | 3.5 G/100 ML AT 25 ºC |
| Merck | 14,6457 |
| BRN | 1730984 |
| Henry's Law Constant | 3.0×10-1 mol/(m3Pa) at 25℃, Brockbank (2013) |
| InChI | 1S/C5H12O/c1-5(2,3)4-6/h6H,4H2,1-3H3 |
| InChIKey | KPSSIOMAKSHJJG-UHFFFAOYSA-N |
| SMILES | CC(C)(C)CO |
| LogP | 1.310 |
| CAS DataBase Reference | 75-84-3(CAS DataBase Reference) |
| NIST Chemistry Reference | 1-Propanol, 2,2-dimethyl-(75-84-3) |
| EPA Substance Registry System | Neopentyl alcohol (75-84-3) |
Safety
| Symbol(GHS) |
  GHS02,GHS07 |
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| Signal word | Danger | |||||||||
| Hazard statements | H228-H332-H335 | |||||||||
| Precautionary statements | P210-P240-P241-P261-P271-P304+P340+P312 | |||||||||
| target organs | Respiratory system | |||||||||
| PPE | Eyeshields, Gloves, type P3 (EN 143) respirator cartridges | |||||||||
| Hazard Codes | Xi,F | |||||||||
| Risk Statements | 10-36/37-11 | |||||||||
| Safety Statements | 16-26-36/37-7/9-33 | |||||||||
| RIDADR | UN 1325 4.1/PG 2 | |||||||||
| OEB | A | |||||||||
| OEL | TWA: 100.0 ppm; 360.0 mg/m3, STEL: 125.0 ppm; 450.0 mg/m3 | |||||||||
| WGK Germany | 1 | |||||||||
| TSCA | TSCA listed | |||||||||
| HazardClass | 4.1 | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 2905199090 | |||||||||
| Storage Class | 4.1B - Flammable solid hazardous materials | |||||||||
| Hazard Classifications |
Acute Tox. 4 Inhalation Flam. Sol. 1 STOT SE 3 |
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| Hazardous Substances Data | 75-84-3(Hazardous Substances Data) | |||||||||
| Limited Quantities | 1.0 Kg (2.2 lbs) | |||||||||
| Excepted Quantities | Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml) | |||||||||
| NFPA 704: |
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