beta-terpineol
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IUPAC name :1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
InChI :InChI=1/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h9,11H,1,4-7H2,2-3H3
InChIKey :RUJPNZNXGCHGID-UHFFFAOYAO
SMILES :CC(=C)C1CCC(CC1)(C)O
cas number :138-87-4
(EINECS) number :205-342-6
beilstein number :2205072
fema number :3564
coe number :10254
jecfa number :374
fl. number :02.097
molar refractivity :47.25 ± 0.3 cm3
parachor :397.6 ± 6.0 cm3
index of refraction :1.476 ± 0.02
surface tension :31.8 ± 3.0 dyne/cm
density :0.921 ± 0.06 g/cm3
polarizability :18.73 ± 0.5 10-24cm3
XlogP : 2.50
molecular weight : 154.2493200
formula :C10 H18 O
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified
organoleptics :
odor type :woody
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  		pungent earthy woody
properties :
appearence :colorless clear liquid
assay : 96.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.93000 to 0.93600 @ 25.00 °C.
pounds per gallon - calc. : 7.739 to 7.788
refractive index :1.48200 to 1.48500 @ 20.00 °C.
melting point : 32.00 to 33.00 °C. @ 760.00 mm Hg
boiling point : 209.00 to 210.00 °C. @ 760.00 mm Hg
congealing point :24.00 °C.
vapor pressure :0.04000 mm/Hg @ 25.00 °C.
flash point : 189.00  °F.  TCC  ( 87.22 °C. )
logP (o/w) : 3.41
safety :
most important hazard(s) :Xi - Irritant
  R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :1.30 (μg/capita/day)
 
recommendation for beta-terpineol usage levels up to :
  3.0000 % in the fragrance concentrate.
safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
Env. Mutagen Info. Center :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
(EINECS) number :205-342-6
chemidplus :000138874
EPA Substance Registry Services :138-87-4
references :
 1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
fl. number :02.097
jecfa number :374
NIST Chemistry WebBook :1717681368
pubchem :151906
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
synonyms :
para-menth-8-en-1-ol
1-methyl-4-(1-methyl ethenyl) cyclohexanol
1-methyl-4-(1-methyl vinyl) cyclohexan-1-ol
1-methyl-4-isopropenyl cyclohexan-1-ol
1-methyl-4-methyl vinyl cyclohexanol
1-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
4-isopropenyl-1-methyl-1-cyclohexanol
soluble in :
 alcohol
 oils
 water, 2200 mg/L 2 15C
(odor and/or flavor) blends with :
isobornyl formate
isocyclocitral
 cyperus root oil
 cypress oil
 dihydro-alpha-ionone
 dihydro-beta-ionone
(E+Z)-4,8-dimethyl-3,7-nonadien-2-yl acetate
alpha-fenchol
dextro-fenchone
 fern absolute
 fir needle oil
 galbanum oil
 germacrene B
 herbal norbornane
6-hydroxydihydrotheaspirane (mixture of isomers)
 linalool oxide
 oakmoss absolute
 oakmoss oil
 orris hexanone
 pinacol
alpha-pinene
 turmeric oleoresin
 vetiver oil
(odor and/or flavor) used in :
 earth humus
natural occurrence in :
data pageboldo leaf oil italy @ 0.13%
data pageboldus leaf oil chile @ 0.07%
data pagecascarilla bark oil @ trace%
data pagecornmint oil india @ 0.01%
data pagelavandin oil china @ 0.45%
data pagelemongrass oil @ 0.17%
data pagemace oil east india @ 0.32%
data pagenutmeg flower oil @ 0.36%
data pagenutmeg leaf oil @ 0.00-0.21%
data pageorange peel oil bitter china @ 0.02%
pine oils
data pagesage oil dalmatian @ 0.30%
data pagethyme oil red CO2 extract @ 0.22%



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