aromadendrene
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IUPAC name :1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
InChI :InChI=1/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3
InChIKey :ITYNGVSTWVVPIC-UHFFFAOYAO
SMILES :CC1CCC2C1C3C(C3(C)C)CCC2=C
cas number :72747-25-2
molar refractivity :64.80 ± 0.4 cm3
parachor :513.8 ± 6.0 cm3
index of refraction :1.505 ± 0.03
surface tension :30.6 ± 5.0 dyne/cm
density :0.93 ± 0.1 g/cm3
polarizability :25.69 ± 0.5 10-24cm3
XlogP : 4.90
XlogP3-AA : 4.70
molecular weight : 204.3510600 (IUPAC)
formula :C15 H24
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
organoleptics :
odor description:
wood
properties :
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
flash point :not determined
safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
safety references :
EPI System :view
 
 
 
 
1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
chemidplus :072747252
EPA Substance Registry Services :72747-25-2
references :
 
1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
pubchem :85150878
other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
10(14)-aromadendrene
1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
soluble in :
 alcohol
insoluble in :
 water
stability :
natural occurrence in :
data pageartemisia campestris spp. glutinosa flower oil italy @ trace% S
data pageartemisia vestita wall. flower oil @ 10.80% S
data pageartemisia vestita wall. leaf oil @ 10.70% S
data pagebay leaf oil @ 0.00-0.09% S
data pagecajuput oil @ 0.9% S
data pagechampaca absolute (michelia alba dc.) @ 0.05% S
data pageclary sage oil greece @ 0.10% S
data pagecroton cajucara benth. leaf oil brazil @ 0.30% S
data pagecurry fruit oil india @ <0.05% S
data pagecurry leaf oil india @ 0.10% S
data pageeucalyptus globulus bicostata oil @ 5.57% S
data pageeucalyptus globulus bud oil @ 16.57% S
data pageeucalyptus globulus fruit oil @ 23.33% S
data pageeucalyptus globulus maidenii f. muell oil @ 12.04% S
data pageeucalyptus globulus oil @ 12.31% S
data pageeucalyptus globulus oil burundia @ 3.60% S
data pageeucalyptus globulus oil zambia @ 0.60% S
data pageeucalyptus globulus pseudoglobulus oil @ 1.16% S
data pageginger root oil brazil @ 0.50% S
data pagehyptis spicigera lam. oil mali @ trace-0.10% S
data pagejuniper berry oil @ 0.60% S
data pagelavender oil CO2 extract france @ 1.02% S
data pagelemon verbena oil turkey @ 0.54% S
data pagelime oil CO2 extract mexico @ 0.18% S
data pagelippia aff. gracillis h.b.k. leaf oil brazil @ 0.50% S
data pagemanuka var. eximium oil australia @ trace% S
data pagemanuka var. rotundifolium oil australia @ 0.60% S
data pagemanuka var. scoparium oil new zealand @ 2.09% S
data pagemarjoram oil sweet morocco @ 0.33% S
data pagemastic fruit oil @ trace% S
data pagemastic leaf oil @ 0.06% S
data pagemicrostrobos fitzgeraldii leaf oil australia @ trace% S
data pagemikania cordata (burm. f.) b.l. robinson var. cordata leaf oil france @ 0.40% S
data pagemyrtle lemon scented leaf oil australia @ 0.20% S
 not found in nature  
data pageoregano oil mexico @ 0.84% S
data pagephoebe oil brazil @ 0.11% S
data pagepolyalthia australis (benth.) jessup leaf oil australia @ 0.20% S
data pageprangos uloptera dc. oil iran @ 1.00% S
data pageprangos uloptera dc. seed oil iran @ trace% S
data pagesage oil reunion @ 0.10% S
data pagesage oil spain @ 0.0-0.2% S
data pagesugandha kokila berry oil @ 0.40% S
data pagesundacarpus amarus (blume) c.n. page leaf oil australia @ 5.90% S
data pagetagete oil CO2 extract @ 0.33% S
data pagetea tree oil australia @ 1.61% S
data pagethyme oil red spain @ trace% S
data pagevassoura oil @ 3.30% S
data pagezanthoxylum bracchyacanthum l. leaf oil australia @ 0.20% S
data pagezanthoxylum nitidum l. leaf oil australia @ 0.80% S
data pagezanthoxylum ovalifolium l. leaf oil australia @ 0.50% S



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