489-86-1

Name (-)-GUAIOL
CAS 489-86-1
EINECS(EC#) 207-702-8
Molecular Formula C15H26O
MDL Number MFCD00043336
Molecular Weight 222.37
MOL File 489-86-1.mol
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Chemical Properties

Definition A bicyclic sesquiterpene alcohol found in guaiac wood oil.
Appearance Crystalline solid. Insoluble in water; soluble in alcohol.
Melting point  91-93 °C(lit.)
alpha  D20 -30° (c = 4 in alc)
Boiling point  132-136℃
density  0.9714 g/cm3 (20℃)
refractive index  1.5100 (589.3 nm 20℃)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Dichloromethane (Sparingly), Ethanol (Slightly), Methanol
form  Solid
pka 15.11±0.29(Predicted)
color  White to Off-White
Odor at 100.00 %. mild guaiacwood tea rose
Odor Type woody
Optical Rotation [α]20/D 28°, c = 4 in ethanol
Merck  13,4572
BRN  2047993
Major Application food and beverages
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C15H26O/c1-10-5-7-12(15(3,4)16)9-14-11(2)6-8-13(10)14/h10-12,16H,5-9H2,1-4H3/t10-,11-,12+/m0/s1
InChIKey TWVJWDMOZJXUID-SDDRHHMPSA-N
SMILES C[C@H]1CC[C@H](CC2=C1CC[C@@H]2C)C(C)(C)O
LogP 4.782 (est)
EPA Substance Registry System 5-Azulenemethanol, 1,2,3,4,5,6,7,8-octahydro-.alpha.,.alpha.,3,8-tetramethyl-, (3S,5R,8S)- (489-86-1)
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Safety Data

Safety Statements 
WGK Germany  3
TSCA  TSCA listed
Storage Class 11 - Combustible Solids

Hazard Information

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