sclarene
Notes :
Blends well with amber and woody notes.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(4aS,8S,8aS)-4,4,8a-trimethyl-7-methylidene-8-(3-methylidenepent-4-enyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene
InChI :InChI=1/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,17-18H,1-3,8-14H2,4-6H3/t17-,18-,20+/m0/s1
InChIKey :KYLKKZSVPLUGCC-CMKODMSKBY
SMILES :CC1(CCC[C@]2([C@H]1CCC(=C)[C@@H]2CCC(=C)C=C)C)C
cas number :511-02-4
molar refractivity :89.38 ± 0.4 cm3
parachor :720.6 ± 6.0 cm3
index of refraction :1.492 ± 0.03
surface tension :30.1 ± 5.0 dyne/cm
density :0.88 ± 0.1 g/cm3
polarizability :35.43 ± 0.5 10-24cm3
xlogp : 6.80
molecular weight : 272.4680800
formula :C20 H32
 
 
fda reg :unspecified h. number :unspecified
organoleptics : 
odor strength :high ,
recommend smelling in a 1.00 % solution or less
odor description :
at 1.00 % in dipropylene glycol.  
powerful woody amber clary sage
properties : 
assay : 95.00 - 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 337.00 - 338.00 °C. @ 760.00 mm Hg
logp : 8.71
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 305.00  °F.  TCC  ( 151.67 °C. )
  
recommendation for sclarene usage levels up to :
  1.0000 % in the fragrance concentrate.
  
safety links : 
chemidplus :511-02-4
epa-srs :511-02-4
  
other : 
 
references : 
pubchem :42402575
  
synonyms :
4,5-decamethylene oxazole
 labda-8(20),13(16),14-triene
 sclarene
(4aS,5S,8aS)-1,1,4a-trimethyl-6-methylene-5-(3-methylene pent-4-enyl) decalin
(odor and/or flavor) blends with :
 amber notes
 woody notes
(odor and/or flavor) used in :
 amber
 clary sage
 woody
natural occurrence in :
data pagecedarleaf oil canada @ trace%
data pagesage oil albania @ 1.90%



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