tetrahydromyrcenol
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IUPAC name :2,6-dimethyloctan-2-ol
InChI :InChI=1/C10H22O/c1-5-9(2)7-6-8-10(3,4)11/h9,11H,5-8H2,1-4H3
InChIKey :WRFXXJKURVTLSY-UHFFFAOYAK
SMILES :CCC(C)CCCC(C)(C)O
cas number :18479-57-7
(EINECS) number :242-361-9
molar refractivity :49.83 ± 0.3 cm3
parachor :439.2 ± 4.0 cm3
index of refraction :1.433 ± 0.02
surface tension :27.6 ± 3.0 dyne/cm
density :0.826 ± 0.06 g/cm3
polarizability :19.75 ± 0.5 10-24cm3
XlogP : 3.90
molecular weight : 158.2810800
formula :C10 H22 O
NMR Predictor :Predict
 
 
export tariff code :2905.19.0000
fda reg :unspecified

Suppliers :
Berje :Tetra Hydro Myrcenol
IFF :Tetrahydro Myrcenol
≥97%
Odor:  Soft, lime, citrus, floral
Moellhausen :tetrahydromyrcenol
95% min. nature identical kosher
Nippon Terpene :Tetrahydromyrcenol
99%
Penta :tetrahydromyrcenol
Sigma-Aldrich-SAFC :Tetrahydromyrcenol
95%
Takasago :Tetrahydro Myrcenol
≥95%
Odor:  Floral

organoleptics :
odor type :citrus
odor strength :medium
odor description :¹
at 100.00 %.  
fresh sweet citrus lime floral lily
odor sample from :Millennium Chemicals
substantivity :6 hour(s) at 100.00 %

properties :
appearence :colorless clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.82100 to 0.82900 @ 25.00 °C.
pounds per gallon - calc. : 6.832 to 6.898
specific gravity :0.82200 to 0.83000 @ 20.00 °C.
pounds per gallon - calc. : 6.848 to 6.914
refractive index :1.43200 to 1.43700 @ 20.00 °C.
boiling point : 197.00 to 201.00 °C. @ 760.00 mm Hg
vapor pressure :0.02500 mm/Hg @ 20.00 °C.
vapor density :5.5 ( Air = 1 )
flash point : 161.00  °F.  TCC  ( 71.67 °C. )
logP (o/w) : 3.54
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.

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 :
 
recommendation for tetrahydromyrcenol usage levels up to :
  30.0000 % in the fragrance concentrate.
recommendation for tetrahydromyrcenol usage levels up to :
 not for flavor use.

safety references :
msds :msds
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 1993
 
WGK Germany :2
 
 
 
 2,6-dimethyloctan-2-ol
(EINECS) number :242-361-9
chemidplus :018479577
EPA Substance Registry Services :18479-57-7

references :
 2,6-dimethyloctan-2-ol
NIST Chemistry WebBook :585044144
pubchem :663598

Cosmetics :
Cosmetic uses : perfuming agents

other :
reference : Luebke, William tgsc, (1994)¹
CosIng :cosmetic data
 C of A
synonyms :
2,6-dimethyl-2-octanol
2,6-dimethyloctan-2-ol

soluble in :
 alcohol

insoluble in :
 water

stability :
 acid cleaner
 alcoholic lotion, good
 antiperspirant, good
 bleach, good
 deo stick
 detergent perborate, good
 fabric softener, good
 hard surface cleaner
 liquid detergent, good
 shampoo
 soap, good

(odor and/or flavor) blends with :
 allyl amyl glycolate
alpha-amyl cinnamaldehyde
isoamyl salicylate
para-anisyl alcohol
 benzyl acetate
 benzyl alcohol
 benzyl benzoate
 benzyl isobutyrate
 benzyl propionate
 benzyl salicylate
 bergamot oil
 blood orange oil
 bois de rose oil
 cedarwood oils
 citronellol
 citronellyl acetate
 citrus carbaldehyde
 clary sage oil
 clover nitrile
 coriander seed oil
 cortex pyridine
para-cresyl caprylate
 cyclamen aldehyde
 cyclohexyl ethyl alcohol
 decanal
 dihydromyrcenol
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl acetate
 dimethyl benzyl carbinyl butyrate
 ethyl heptanoate
 floral pyranol
 galbanum oil
 gardenia oxide
 geraniol
 geranyl acetate
 grapefruit pentanol
 green acetate
(Z)-3-hexen-1-ol
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 hexyl tiglate
 hyacinth ether
 hydroxycitronellal
 ionones
2,4-ivy carbaldehyde
 leerall
 lemon oil
 lilyall
 lime oil
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 melon nonenoate
 methyl cinnamate
 methyl dihydrojasmonate
 methyl heptenone
 methyl ionones
2-methyl undecanal
 mimosa absolute
 muguet carboxaldehyde
 muguet octadienol
 musks
 nerol
 neryl acetate
 nonanal
 nopyl acetate
 ocean propanal
 octanal
 orange oil
 patchouli ethanone
 petitgrain oil
 phenethyl acetate
 phenethyl alcohol
 phenyl acetaldehyde dimethyl acetal
3-phenyl propionaldehyde
 rhodinol
 rose butanoate
 rose oxides
 santall
 styralyl acetate
alpha-terpineol
alpha-terpinyl acetate
 tetrahydrolinalool
gamma-undecalactone
 violet leaf absolute
 violet methyl carbonate
 woody acetate
 woody amylene

(odor and/or flavor) used in :
 agrumen
 aldehydic
 amber
 apple crabapple
 apple green apple
 bark
 bergamot
 blossom tropical blossom
 bubblegum
 calamus
 cider
 citronella
 citrus
 cloudberry bakeapple
 colonia
 curacao
 cypress
 elder blossom
 fern fougere
 fir balsam
 floral
 florida breeze
 forest
 grape
 grass sweet grass
 guava
 herbal
 hibiscus
 kewda
 kumquat
 lavender
 lemon
 lily
 lime
 linden blossom limeflower tilleul
 mint
 muguet lily of the valley
 orange mock orange
 pansy
 pear
 petitgrain
 petitgrain bergamot petitgrain
 pine
 pineapple
 rain
 rhubarb
 starfruit
 sweet pea pois de senteur
 wet fields
 wintergreen
 woody

natural occurrence in :
not found in nature



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