3-Butoxyphenol
- CAS NO.:18979-72-1
- Empirical Formula: C10H14O2
- Molecular Weight: 166.22
- MDL number: MFCD00058976
- EINECS: 242-715-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-06-08 17:06:37
What is 3-Butoxyphenol?
The Uses of 3-Butoxyphenol
3-Butoxyphenol is an inhibitor of oral bacteria. Antibacterial agent.
What are the applications of Application
3-Butoxyphenol is used in organic synthesis. It is used to synthesize 3BOP-daC12 Benzoxazine and 2-butoxy-6-benzyloxybenzaldehyde.
Synthesis
1)Stir a solution of 1,5-dihydroxybenzene (5 mmol ) and cerium trifluoromethanesulfonate (0.1 mmol ) in 1-butanol (10 mmol, 5.4 mL) at 130 °C for 5 days in round bottom flask.
2)Quench the mixture with water (20 mL).
3)Extract the reaction mixture three times with dichloromethane (3 x10 mL).
4)Wash the combined organic layers with brine (15 mL).
5)Dry the combined organic layers over MgSO4.
6)Concentrate the combined organic layers.
7)Purify the crude product by column chromatography (Cyclohexane-ethyl acetate 99/1) to obtain 3-butoxyphenol.
Properties of 3-Butoxyphenol
Melting point: | 65-66 °C(lit.) |
Boiling point: | 269 °C |
Density | 1,05 g/cm3 |
refractive index | 1.5230-1.5260 |
storage temp. | 2-8°C |
form | clear liquid |
pka | 9.61±0.10(Predicted) |
color | Colorless to Light orange to Yellow |
Water Solubility | 1.37g/L(30 ºC) |
CAS DataBase Reference | 18979-72-1(CAS DataBase Reference) |
Safety information for 3-Butoxyphenol
Signal word | Warning |
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P280:Wear protective gloves/protective clothing/eye protection/face protection. |
Computed Descriptors for 3-Butoxyphenol
InChIKey | VGIJZDWQVCXVNL-UHFFFAOYSA-N |
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