(-)-alpha-cubebene
 
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InChI :InChI=1/C15H24/c1-9(2)12-6-5-11(4)15-8-7-10(3)13(15)14(12)15/h7,9,11-14H,5-6,8H2,1-4H3
InChIKey :XUEHVOLRMXNRKQ-UHFFFAOYAN
SMILES :CC1CCC(C2C13C2C(=CC3)C)C(C)C
cas number :17699-14-8
molar refractivity :64.94 ± 0.4 cm3
parachor :512.3 ± 6.0 cm3
index of refraction :1.512 ± 0.03
surface tension :31.4 ± 5.0 dyne/cm
density :0.94 ± 0.1 g/cm3
polarizability :25.74 ± 0.5 10-24cm3
xlogp : 4.80
molecular weight : 204.3510600
formula :C15 H24
 
 
export tariff code :unspecified
fda reg :unspecified
 
 

organoleptics :
odor type :herbal
odor strength :medium
odor description :
at 100.00 %.  
herbal waxy

properties :
appearence :colorless clear liquid
assay : 97.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.88900 @ 25.00 °C.
refractive index :1.48200 @ 20.00 °C.
boiling point : 245.00 - 246.00 °C. @ 760.00 mm Hg
logp : 6.15

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) :> 212.00  °F.  TCC  ( > 100.00 °C. )
  
recommendation for (-)-alpha-cubebene usage levels up to :
  2.0000 % in the fragrance concentrate.
  

safety links :
chemidplus :017699148
epa-srs :17699-14-8
  

other :
 

references :
pubchem :663464
NIST Chemistry WebBook :3403226674
  
synonyms :
(-)-alpha-cubebene
alpha-cubebene
(3aS-(3aalpha,3bbeta,4beta,7alpha,7aS*))-3a,3b,4,5,6,7-hexahydro-3,7-dimethyl-4-(1-methyl ethyl)-1H-cyclopenta(1,3)cyclopropa(1,2)benzene
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) used in :
 floral
 herbal
 waxy
natural occurrence in :
data pageallamanda cathartica linn. flower oil brazil @ 0.10%
data pageangelica seed oil CO2 extract @ trace%
data pageayou wood oil @ 1.40%
data pagebasil flower oil sweet @ 0.77%
data pagebasil leaf oil sweet (ocimum basilicum) @ 0.66%
data pagebay leaf oil @ 0.00-<0.01%
data pagecascarilla bark oil @ 0.04%
data pagecedrela wood oil @ 8.00%
data pagechamomile oil morocco @ 0.30%
data pageclary sage oil france @ trace%
data pageclary sage oil spain @ 0.36%
data pageclove bud oil @ 0.66%
data pageclove leaf oil @ 0.08%
data pageclove stem oil india @ 0.49%
data pagecroton cajucara benth. leaf oil brazil @ trace%
data pagecroton flavens l. (welensali) leaf oil curacao @ 0.20%
data pagecubeb oil @ 1.65%
data pagecurry wood leaf oil australia @ 0.20%
data pagecypress oil @ 0.07-0.15%
data pagedill weed oil cuba @ trace%
data pageeucalyptus globulus bud oil @ 0.27%
data pageeucalyptus globulus fruit oil @ 0.34%
data pageeucalyptus globulus oil @ 0.25%
data pageeucalyptus globulus oil rwanda @ 0.03%
data pagegalangal root oil @ 0.04%
data pagegeranium petiole oil india @ 0.10%
data pagegeranium rose-scented oil (pelargonium spp.) cuba @ 0.10%
data pagegeranium stem oil india @ 0.29%
data pageguava fruit oil reunion @ 0.10%
data pagehyptis suaveolens (l.) poit. oil mali @ trace-0.10%
data pagejuniper berry oil @ 0.90%
data pagejuniper branch oil @ 0.50%
data pagelabdanum oil @ 0.30%
data pagelime oil expressed florida @ trace%
data pagemanuka var. scoparium oil new zealand @ 3.95%
data pagemarsypianthes chamaedrys (vahl) kuntze oil brazil @ 0.20%
data pagemelissa oil slovak republic @ 0.26%
data pagemikania cordata (burm. f.) b.l. robinson var. cordata leaf oil france @ 0.10%
data pageorange peel oil bitter china @ trace%
data pagepepper oil black india @ 0.10%
data pagepepper tree berry oil @ 0.13%
data pagepepper tree leaf oil @ 0.01%
data pagepeppermint oil CO2 extract @ trace%
data pagephlomis fruticosa l. flower oil greece @ 1.90%
data pagephoebe oil brazil @ 0.42%
data pagepine needle oil dwarf @ 0.33%
data pagepiper cernum vell. var. cernum yuncker leaf oil brazil @ 0.30%
data pagepolyalthia australis (benth.) jessup leaf oil australia @ 0.30%
data pagerosemary oil CO2 extract @ 0.43%
data pagesage oil spain @ 0.0-0.2%
data pagesantolina oil @ 0.66%
data pagesugandha kokila berry oil @ 0.70%
data pagesundacarpus amarus (blume) c.n. page leaf oil australia @ trace%
data pagetea tree oil australia @ 0.09%
data pagewormwood oil annus vietnam @ 0.97%
data pagezanthoxylum nitidum l. leaf oil australia @ 0.70%



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