alpha-methyl cinnamyl alcohol
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Notes :
It can be used in a wide variety of fragrance types, to add a sweet, balsamic, almond-spice note. It works well as a modifier in muguet as well as oriental types.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(E)-4-phenylbut-3-en-2-ol
InChI :InChI=1/C10H12O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-7,11H,8H2,1H3/b9-7-
InChIKey :LLNAMUJRIZIXHF-CLFYSBASBK
SMILES :CC(\C=C\C1=CC=CC=C1)O
cas number :1504-55-8
(EINECS) number :216-128-7
molar refractivity :48.15 ± 0.3 cm3
parachor :362.9 ± 4.0 cm3
index of refraction :1.582 ± 0.02
surface tension :40.1 ± 3.0 dyne/cm
density :1.027 ± 0.06 g/cm3
polarizability :18.08 ± 0.5 10-24cm3
XlogP : 2.30
molecular weight : 148.2016800
formula :C10 H12 O
NMR Predictor :Predict
 
 
export tariff code :2906.29.0000
fda reg :unspecified

Suppliers :
Sigma-Aldrich-Aldrich :trans-2-Methyl-3-phenyl-2-propen-1-ol
95%

organoleptics :
odor type :balsamic
odor strength :medium
odor description :
at 100.00 %.  
sweet balsam floral oriental styrax
substantivity :48  Hour(s)

properties :
appearence :colorless to pale yellow liquid to solid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.02700 to 1.03200 @ 25.00 °C.
pounds per gallon - calc. : 8.546 to 8.587
refractive index :1.57000 to 1.57500 @ 20.00 °C.
boiling point : 288.00 to 289.00 °C. @ 760.00 mm Hg
boiling point : 77.00 °C. @ 0.10 mm Hg
flash point :> 200.00  °F.  TCC  ( > 93.33 °C. )
logP (o/w) : 2.25

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) :
  Oral-Rat    2400.00  ul/kg

Dermal Toxicity(LD50) :
  Skin-Rabbit  >5000.00  mg/kg

Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for alpha-methyl cinnamyl alcohol usage levels up to :
  20.0000 % in the fragrance concentrate.
recommendation for alpha-methyl cinnamyl alcohol 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
 
 
 
 (E)-4-phenylbut-3-en-2-ol
(EINECS) number :216-128-7
RTECS :GE2340000 for 1504-55-8
chemidplus :017488652
EPA Substance Registry Services :1504-55-8

references :
 (E)-4-phenylbut-3-en-2-ol
NIST Chemistry WebBook :1504558
pubchem :204610

Cosmetics :
Cosmetic uses : perfuming agents

other :
CosIng :cosmetic data
synonyms :
alpha-methyl cinnamic alcohol
2-methyl-3-phenyl-2-propen-1-ol
alpha-methyl-3-phenyl-2-propen-1-ol
(E)-4-phenylbut-3-en-2-ol

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 amyl isoeugenol
 benzoin absolute sumatra
 benzoin resinoid sumatra
 benzyl cinnamate
 benzyl propionate
alpha-bisabolene
 cananga oil
 cananga oil china
 cardamom absolute
 cinnamic acid
 cinnamyl acetate
 cinnamyl benzoate
 cinnamyl cinnamate
 citronellyl acetone
 clary sage absolute
 copaiba balsam oil
 cyclohexyl crotonate
 cyclohexyl salicylate
 dihydrogeranyl linalool
 elder flowers absolute
 eucalyptus citriodora oil
isoeugenyl ethyl acetal
 floral undecenone
 heliotropyl diethyl acetal
(Z)-3-hexen-1-yl benzoate
 hydroxycitronellal
beta-ionol
pseudoionone
(Z)-jasmone
 lilyall
 marigold pot absolute
4-methyl biphenyl
alpha-methyl cinnamic alcohol
 methyl hydrocinnamate
 myrrh resinoid
 opoponax oil
 opoponax resinoid
 phenethyl propionate
 phenethyl salicylate
2-phenoxyethyl formate
3-phenyl propionaldehyde
3-phenyl propyl acetate
3-phenyl propyl propionate
1-phenyl-1-propanol
4-phenyl-3-buten-2-ol
(Z,E)-phytol
 rose oil
 sandal cyclopropane
 tuberose absolute
 tuberose absolute concrete
 wormwood oil annus france
 wormwood oil annus vietnam
 ylang ylang absolute

(odor and/or flavor) used in :
 balsam
 muguet lily of the valley
 oriental
 spice

natural occurrence in :
not found in nature



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