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(-)-THUJOPSEN Structure

(-)-THUJOPSEN

Chemical Properties

Melting point <25 °C
alpha  D -110° (c = 2 in chloroform)
Boiling point 258-260 °C(lit.)
Density  0.936 g/mL at 20 °C(lit.)
refractive index  n20/D 1.505
Flash point 104°C
storage temp.  Amber Vial, Refrigerator, Under inert atmosphere
solubility  Chloroform (Sparingly), Dichloromethane (Slightly)
form  Oil
color  Colourless
BRN  1907465
InChI 1S/C15H24/c1-11-6-9-14(4)8-5-7-13(2,3)15(14)10-12(11)15/h6,12H,5,7-10H2,1-4H3/t12-,14-,15-/m0/s1
InChIKey WXQGPFZDVCRBME-QEJZJMRPSA-N
SMILES CC1=CC[C@]2(C)CCCC(C)(C)[C@@]23C[C@@H]13
LogP 6.053 (est)
EPA Substance Registry System Cyclopropa[d]naphthalene, 1,1a,4,4a,5,6,7,8-octahydro-2,4a,8,8-tetramethyl-, (1aS,4aS,8aS)- (470-40-6)

Safety Information

Safety Statements  23-24/25
RIDADR  1993
WGK Germany  3
TSCA  TSCA listed
HazardClass  3.2
PackingGroup  III
Storage Class 10 - Combustible liquids

MSDS

Usage And Synthesis

Preparation Products And Raw materials

(-)-THUJOPSEN Supplier