3,3-DIMETHYL-1-BUTANOL
Synonym(s):Neohexanol
- CAS NO.：624-95-3
- Empirical Formula: C6H14O
- Molecular Weight: 102.17
- MDL number: MFCD00002928
- EINECS: 210-872-6
- SAFETY DATA SHEET (SDS)
- Update Date: 2026-04-21 10:31:43
What is 3,3-DIMETHYL-1-BUTANOL?
Chemical properties
colorless liqui
The Uses of 3,3-DIMETHYL-1-BUTANOL
3,3-Dimethyl-1-butanol, is an organic building block used for the synthesis of various pharmaceutical compounds. It is an important intermediate in the synthesis of Neotame, an enhanced sweetening agent.
General Description
3,3-Dimethyl-1-butanol is a glass forming material. The molecular dynamics of 3,3-dimethyl-1-butanol was studied.
Properties of 3,3-DIMETHYL-1-BUTANOL
| Melting point: | −60 °C(lit.) |
| Boiling point: | 143 °C(lit.) |
| Density | 0.844 g/mL at 25 °C(lit.) |
| refractive index | n |
| Flash point: | 118 °F |
| storage temp. | 2-8°C |
| form | clear liquid |
| pka | 15.17±0.10(Predicted) |
| color | Colorless to Almost colorless |
| Water Solubility | Slightly soluble in water. |
| BRN | 1731466 |
| CAS DataBase Reference | 624-95-3(CAS DataBase Reference) |
| NIST Chemistry Reference | 1-Butanol, 3,3-dimethyl-(624-95-3) |
| EPA Substance Registry System | 3,3-Dimethyl-1-butanol (624-95-3) |
Safety information for 3,3-DIMETHYL-1-BUTANOL
| Signal word | Warning |
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H226:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
Computed Descriptors for 3,3-DIMETHYL-1-BUTANOL
| InChIKey | DUXCSEISVMREAX-UHFFFAOYSA-N |
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