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4-(1-Adamantyl)phenol Structure

4-(1-Adamantyl)phenol

Chemical Properties

Melting point 181-183 °C(lit.)
Boiling point 182-183 °C
Density  1.160±0.06 g/cm3(Predicted)
storage temp.  Inert atmosphere,Room Temperature
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Very Slightly, Heated)
form  Solid
pka 10.02±0.15(Predicted)
color  White to Pale Brown
InChI InChI=1S/C16H20O/c17-15-3-1-14(2-4-15)16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13,17H,5-10H2
InChIKey KZMYFIUFUAOZHP-UHFFFAOYSA-N
SMILES C1(O)=CC=C(C23CC4CC(CC(C4)C2)C3)C=C1
CAS DataBase Reference 29799-07-3(CAS DataBase Reference)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-37/39
WGK Germany  3
HazardClass  IRRITANT
HS Code  2907290090

MSDS

Usage And Synthesis

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