2-(1-Adamantyl)-4-methylphenol Structure

2-(1-Adamantyl)-4-methylphenol

Chemical Properties

Melting point 128-130 °C(lit.)
Boiling point 359.9±21.0 °C(Predicted)
Density  1.137±0.06 g/cm3 (20 ºC 760 Torr)
form  Powder
pka 10.43±0.43(Predicted)
color  White
Water Solubility  Sparingly Soluble in water (7.8E-3 g/L) (25°C).
InChI 1S/C17H22O/c1-11-2-3-16(18)15(4-11)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,12-14,18H,5-10H2,1H3/t12-,13+,14-,17-
InChIKey XHLJIHBDAJFXBE-ZZNDEYBLSA-N
SMILES Cc1ccc(O)c(c1)C23C[C@H]4C[C@H](C[C@H](C4)C2)C3
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HazardClass  IRRITANT
HS Code  2907290090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
1
2 0

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2-(1-Adamantyl)-4-methylphenol Chemical Properties,Usage,Production

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