amber acetate
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Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(2-butan-2-yl-1-ethenylcyclohexyl) acetate
InChI :InChI=1/C14H24O2/c1-5-11(3)13-9-7-8-10-14(13,6-2)16-12(4)15/h6,11,13H,2,5,7-10H2,1,3-4H3
InChIKey :KOSQMCNVEGXSCQ-UHFFFAOYAY
SMILES :CCC(C)C1CCCCC1(C=C)OC(=O)C
cas number :37172-02-4
(EINECS) number :253-377-0
molar refractivity :66.41 ± 0.4 cm3
parachor :568.1 ± 6.0 cm3
index of refraction :1.462 ± 0.03
surface tension :30.8 ± 5.0 dyne/cm
density :0.93 ± 0.1 g/cm3
polarizability :26.32 ± 0.5 10-24cm3
XlogP : 4.40
XlogP3-AA : 4.10
molecular weight : 224.3391600 (IUPAC)
formula :C14 H24 O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Givaudan :Dihydro Ambrate
Odor:  Woody, Ambery
Nanjing :cyclohexanol,1-vinyl-2-(1-methylpropyl)-,acetate,GLC
Penta :dihydroambrate
Vigon :Dihydroambrate
Odor:  WOODY, AMBER.

organoleptics :
odor type :amber
odor strength :medium
odor description :
at 100.00 %.  
woody amber
substantivity :24  Hour(s)

properties :
appearence :colorless to pale yellow clear liquid
assay : 95.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 268.00 to 269.00 °C. @ 760.00 mm Hg
vapor pressure :0.01870 mm/Hg @ 20.00 °C.
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 4.85

safety :
most important hazard(s) :Xi - Irritant
  R 36/37/38 - Irritating to eyes, respiratory system, and skin.
S 02 - Keep out of the reach of children.
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) :
  Oral-Rat    5000.00  mg/kg

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

safety in use :
 
recommendation for amber acetate usage levels up to :
  5.0000 % in the fragrance concentrate.
recommendation for amber acetate usage levels up to :
 not for flavor use.

safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 (2-butan-2-yl-1-ethenylcyclohexyl) acetate
(EINECS) number :253-377-0
chemidplus :037172024
EPA Substance Registry Services :37172-02-4

references :
 (2-butan-2-yl-1-ethenylcyclohexyl) acetate
pubchem :739776

Cosmetics :
Cosmetic uses : perfuming agents

other :
CosIng :cosmetic data
synonyms :
(2-butan-2-yl-1-ethenylcyclohexyl) acetate
 dihydroambrate
2-methyl propyl-1-vinyl cyclohexyl acetate
2-(1-methyl propyl)-1-vinyl cyclohexyl acetate
1-vinyl-2-(1-methyl propyl) cyclohexyl acetate

soluble in :
 alcohol
 water, 17 mg/L @ 20C

insoluble in :
 water

(odor and/or flavor) blends with :
 amber carbinol
 ambroxan
isoamyl benzoate
alpha-amyl cinnamaldehyde
isoamyl salicylate
 amyris wood oil
 angelica root oil
 animal carbolactone
para-anisaldehyde
para-anisyl alcohol
 benzyl acetate
 benzyl alcohol
 benzyl cinnamate
 benzyl isobutyrate
 benzyl propionate
 benzyl salicylate
 bergamot oil
 bois de rose oil
laevo-bornyl acetate
isobutyl cinnamate
isobutyl quinoline
isobutyl salicylate
 caraway seed oil
 carrot seed oil
 cedarwood oils
 cinnamyl alcohol
 citronellol
 citronellyl acetate
 citrus carbaldehyde
 clary sage oil
 clove bud oil
 clover nitrile
 coriander seed oil
 costus valerolactone
para-cresyl caprylate
 currant bud absolute black
 cyclamen aldehyde
 cyclohexyl ethyl alcohol
 davana oil
9-decen-1-ol
 dihydrojasmone
 dimethyl anthranilate
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl isobutyrate
 dodecanal
 dodecanol
 ethyl laurate
 ethyl phenyl acetate
 ethyl vanillin
isoeugenyl acetate
 fir balsam absolute
 floral pyranol
 frankincense oil
 gardenia oxide
 geraniol
 geranyl acetate
 green acetate
 guaiacwood oil
 heliotropyl acetone
 heliotropyl diethyl acetal
(Z)-3-hexen-1-ol
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl salicylate
(Z)-3-hexen-1-yl tiglate
alpha-hexyl cinnamaldehyde
 hyacinth ether
 indole
 ionones
2,4-ivy carbaldehyde
 labdanum resinoid
 leerall
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 melon nonenoate
 methyl anthranilate
 methyl cedryl ketone
 methyl cinnamate
 methyl dihydrojasmonate
 methyl ionones
 mimosa absolute
 muguet carboxaldehyde
 musks
 nerol
 nerolidol
 neryl acetate
 oakmoss absolute
 ocean propanal
 orris pyridine
 patchouli ethanone
 peony alcohol
 phenethyl acetate
 phenethyl alcohol
 phenethyl isobutyrate
 phenethyl propionate
3-phenyl propionaldehyde
3-phenyl propyl alcohol
 raspberry ketone methyl ether
 rhodinol
 rose butanoate
 santall
 strawberry glycidate 1
 styralyl acetate
alpha-terpineol
alpha-terpinyl acetate
 tonka bean absolute
gamma-undecalactone
 verymoss
 vetiver oil
 violet leaf absolute
 violet methyl carbonate
 watermelon ketone
 woody acetate
 woody amylene
 woody propanol

(odor and/or flavor) used in :
 amber
 balsam
 moss
 oriental
 woody

natural occurrence in :
not found in nature



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