lavandulol
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IUPAC name :5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
InChI :InChI=1/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h5,10-11H,3,6-7H2,1-2,4H3
InChIKey :CZVXBFUKBZRMKR-UHFFFAOYAE
SMILES :CC(=CCC(CO)C(=C)C)C
cas number :58461-27-1
(EINECS) number :261-264-2
molar refractivity :49.33 ± 0.3 cm3
parachor :412.6 ± 4.0 cm3
index of refraction :1.461 ± 0.02
surface tension :27.7 ± 3.0 dyne/cm
density :0.857 ± 0.06 g/cm3
polarizability :19.55 ± 0.5 10-24cm3
XlogP : 2.20
molecular weight : 154.2493200 (IUPAC)
formula :C10 H18 O
NMR Predictor :Predict
 
 
export tariff code :2905.20
fda reg :unspecified
organoleptics :
odor strength :medium
odor description:
at 100.00 %.  		delicate farnesol-like
properties :
appearence :colorless to pale yellow clear liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87850 @ 25.00 °C.
refractive index :1.46830 @ 20.00 °C.
boiling point : 94.00 to 95.00 °C. @ 13.00 mm Hg
boiling point : 229.00 to 230.00 °C. @ 760.00 mm Hg
flash point : 191.00  °F.  TCC  ( 88.33 °C. )
logP (o/w) : 3.08
safety :
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :fragrance agents
 
recommendation for lavandulol fragrance usage levels up to :
  1.0000 % in the fragrance concentrate.
recommendation for lavandulol flavor usage levels up to :
 not for flavor use.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
 
 
 
5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
(EINECS) number :261-264-2
chemidplus :058461271
EPA Substance Registry Services :58461-27-1
references :
Leffingwell :chirality
 
5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
NIST Chemistry WebBook :385944780
pubchem :671123
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
synonyms :
 lavandulol
5-methyl-2-(1-methyl ethenyl)-4-hexen-1-ol
5-methyl-2-prop-1-en-2-ylhex-4-en-1-ol
isopropenyl methyl hexenol
2-isopropenyl-5-methyl hex-4-en-1-ol
2-isopropenyl-5-methyl-4-hexen-1-ol
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :    note
data pageartemisia santolina schrenk oil iran @ 37.20% S
data pagecurry leaf oil india @ 0.10% S
data pagelavandin oil abrialis @ 0.55% S
data pagelavandin oil grosso @ 0.84% S
data pagelavandin water (lavandula hydrida) @ 1.36% S
 lavender  
data pagelavender oil CO2 extract france @ 0.31% S
data pagelavender oil greece @ 3.09% S
data pagelavender oil spike france @ 0.50% S
data pagelavender spike water @ 0.05% S
data pagelavender water bulgaria @ 2.87% S
data pagerosemary oil france @ 0.00-0.06% S
data pagerosemary oil morocco @ 0.00-0.23% S
data pagewormwood oil america @ 0.71% S
data pageyarrow oil @ 2.00% S
data pageyarrow oil greece @ 0.10% S

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