terpineol acetate
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Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
InChI :InChI=1/C12H20O2/c1-9(2)12(14-11(4)13)7-5-10(3)6-8-12/h5,7,9-10H,6,8H2,1-4H3
InChIKey :VADBNYMWNNFOSH-UHFFFAOYAP
SMILES :CC1CCC(C=C1)(C(C)C)OC(=O)C
cas number :8007-35-0
(EINECS) number :232-357-5
fema number :3047
coe number :205
jecfa number :368
fl. number :09.830
molar refractivity :56.58 ± 0.3 cm3
parachor :484.7 ± 6.0 cm3
index of refraction :1.466 ± 0.02
surface tension :31.8 ± 3.0 dyne/cm
density :0.962 ± 0.06 g/cm3
polarizability :22.43 ± 0.5 10-24cm3
XlogP : 3.10
molecular weight : 196.2860000
formula :C12 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2915.39.0000
fda reg :unspecified

Suppliers :
IFF :Terpinyl Acetate Extra
Odor:  Sweet, herbaceous, floral with lavender nuances.
IFF :Terpinyl Acetate JAX
Odor:  Sweet, herbaceous, floral with fresh lavender
Nippon Terpene :alpha-Terpinyl acetate
99%
Penta :alpha-terpinyl acetate

organoleptics :
odor type :herbal
odor strength :medium
odor description :
at 100.00 %.  
sweet herbal bergamot pine
substantivity :24  Hour(s)

properties :
appearence :colorless to pale yellow clear liquid
assay : 98.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
flash point : 212.00  °F.  TCC  ( 100.00 °C. )
logP (o/w) : 3.96

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) :
  Gavage-Rat   [sex: M,F]  5075.00  mg/kg
(Jenner et al., 1964)

Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :220.00 (μg/capita/day)
 
recommendation for terpineol acetate usage levels up to :
  6.0000 % in the fragrance concentrate.
recommendation for terpineol acetate usage levels up to :
 not for flavor use.

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
Toxicology Citations :Search
Env. Mutagen Info. Center :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 (4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
(EINECS) number :232-357-5
chemidplus :008007350
EPA Substance Registry Services :8007-35-0

references :
 (4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
fl. number :09.830
jecfa number :368
pubchem :149608

Cosmetics :
Cosmetic uses : masking agents

other :
CosIng :cosmetic data
synonyms :
para-menthenol acetate
(4-methyl-1-propan-2-yl-1-cyclohex-2-enyl) acetate
 terpinyl acetate
 terpinyl acetate jax

soluble in :
 alcohol

insoluble in :
 water

stability :
 alcoholic lotion
 antiperspirant
 deo stick
 detergent
 fabric softener
 hard surface cleaner
 shampoo
 soap

(odor and/or flavor) blends with :
 allyl amyl glycolate
 allyl cyclohexyl propionate
isoamyl acetate
isoamyl benzoate
alpha-amyl cinnamaldehyde
isoamyl salicylate
para-anisaldehyde
para-anisyl acetate
para-anisyl alcohol
 benzyl acetate
 benzyl isobutyrate
 benzyl propionate
 bergamot oil
 blood orange oil
 bois de rose oil
 cinnamyl alcohol
 citral
 citronellyl acetate
 citrus carbaldehyde
 clary sage oil
 clover nitrile
 coriander seed oil
 cyclamen aldehyde
 cyclohexyl ethyl alcohol
 decanal
 diethyl malonate
 dihydromyrcenol
 dodecanal
 ethyl acetoacetate
 ethyl butyrate
 ethyl cinnamate
 ethyl heptanoate
 ethyl vanillin
 fir balsam absolute
 fir needle oil
 floral pyranol
 frankincense oil
 galbanum oil
 geraniol
 geranyl acetate
 grapefruit pentanol
 green acetate
 heliotropin
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl salicylate
 hexyl acetate
alpha-hexyl cinnamaldehyde
 ho leaf oil
 hyacinth ether
 ionones
 leaf acetal
 leerall
 lemon oil
 lemongrass oil
 lime oil
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 methyl benzoate
 methyl dihydrojasmonate
 methyl heptenone
 muguet octadienol
 nerol
 neryl acetate
 nonanal
 nonanol
 nopyl acetate
 ocean propanal
 orange oil
 petitgrain oil
 phenethyl acetate
 phenethyl alcohol
 rose butanoate
 santall
 strawberry glycidate 1
 styralyl acetate
alpha-terpineol
 tetrahydrolinalool
 tetrahydromyrcenol
gamma-undecalactone
 vanilla absolute
 verbena oil
 woody acetate
 woody amylene

(odor and/or flavor) used in :
 bergamot
 citrus
 fir
 floral
 herbal
 pine
 woody

natural occurrence in :
not found in nature



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