dihydroeugenol
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Notes :
Blends well with all eugenyl components.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :2-methoxy-4-propylphenol
InChI :InChI=1/C10H14O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h5-7,11H,3-4H2,1-2H3
InChIKey :PXIKRTCSSLJURC-UHFFFAOYAA
SMILES :CCCC1=CC(=C(C=C1)O)OC
cas number :2785-87-7
(EINECS) number :220-499-0
beilstein number :1866292
fema number :3598
jecfa number :717
fl. number :04.049
molar refractivity :48.99 ± 0.3 cm3
parachor :395.3 ± 4.0 cm3
index of refraction :1.519 ± 0.02
surface tension :36.1 ± 3.0 dyne/cm
density :1.031 ± 0.06 g/cm3
polarizability :19.42 ± 0.5 10-24cm3
XlogP : 3.00
molecular weight : 166.2169600 (IUPAC)
formula :C10 H14 O2
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Berje :Dihydro Eugenol
Penta :2-methoxy-4-propylphenol
Sigma-Aldrich-SAFC :2-Methoxy-4-propylphenol
≥99%, Kosher
Odor:  anise; apricot; clove; oily; spicy; floral; fishy; meaty; pepper; soapy; wine-like; woody.
Vigon :Dihydro Eugenol
Odor:  SPICY, FLORAL, WOODY

organoleptics :
odor type :spicy
odor strength :medium
odor description :¹
at 100.00 %.  
clove sharp spicy sweet phenolic powdery allspice
odor sample from :International Flavors & Fragrances Inc.
substantivity :92  Hour(s)

properties :
appearence :colorless clear liquid
assay : 99.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.03600 to 1.03750 @ 25.00 °C.
pounds per gallon - calc. : 8.621 to 8.633
refractive index :1.52430 to 1.52570 @ 20.00 °C.
boiling point : 125.00 to 126.00 °C. @ 14.00 mm Hg
flash point :> 230.00  °F.  TCC  ( > 110.00 °C. )
logP (o/w) : 2.71

safety :
most important hazard(s) :T - Toxic.
  R 24 - Toxic in contact with skin.
R 38 - Irritating to skin.
S 02 - Keep out of the reach of children.
S 20/21 - When using do not eat, drink or smoke.
S 36/37 - Wear suitable protective clothing and gloves.
S 45 - In case of accident or if you feel unwell seek medical advice immediately.
Oral Toxicity(LD50) :
  Oral-Rat    2600.00  mg/kg
FCTOD7  20,671,1982

Oral-Mouse    2000.00  mg/kg

Intraperitoneal-Mouse    150.00  mg/kg

Dermal Toxicity(LD50) :
  Skin-Rabbit  310.00  mg/kg
FCTOD7  20,671,1982

Subcutaneous-Mouse  1450.00  mg/kg

Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :180.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.10 (μg/capita/day)
 
recommendation for dihydroeugenol 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
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 2810
 
WGK Germany :2
 
 
 
 2-methoxy-4-propylphenol
(EINECS) number :220-499-0
RTECS :SL8050000 for 2785-87-7
chemidplus :002785877
EPA Substance Registry Services :2785-87-7
dtp/nci :53043

references :
 2-methoxy-4-propylphenol
fl. number :04.049
jecfa number :717
NIST Chemistry WebBook :2929974978
pubchem :160869

Cosmetics :
Cosmetic uses : perfuming agents

other :
reference : Luebke, William tgsc, (1991)¹
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
synonyms :
 cerulignol
 coerulignol
 guaiacyl propane
 guaiacylpropane
(4-hydroxy-3-methoxyphenyl) propane
1-(4-hydroxy-3-methoxyphenyl) propane
4-hydroxy-3-methoxypropyl benzene
2-methoxy-4-propyl phenol
2-methoxy-4-propylphenol
4-propyl guaiacol
para-propyl guaiacol
para-N-propyl guaiacol
4-propyl guaicol
4-propyl-2-methoxyphenol
1-propyl-3-methoxy-4-hydroxybenzene
5-propyl-ortho-hydroxyanisole
4-propyl-ortho-methoxyphenol
4-propylguaiacol

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 allspice oil
 allspice oleoresin
 amyl isoeugenol
 bay leaf oil
 benzyl isoeugenol
 calamus leaf oil
 caryophyllene
beta-caryophyllene
 cassie absolute
 champaca absolute
 cinnamon leaf oil
 clove bud oil
 clove bud oleoresin
 clove leaf oil
 clove leaf oil terpeneless
isocyclogeraniol
 dianthus ethone
 eugenol
(E)-isoeugenol
(Z)-isoeugenol
isoeugenol
 eugenyl acetate
isoeugenyl acetate
 eugenyl phenyl acetate
isoeugenyl phenyl acetate
 methyl eugenol
4-methyl guaiacol
 methyl isoeugenol
 phenethyl salicylate
 phenyl amyl alcohol
 pimento berry oil
 tobacco flower absolute
 wallflower absolute

(odor and/or flavor) used in :
 carnation dianthus oeillet
 chypre
 clove
 fern fougere
 herbal
 oriental
 spice

natural occurrence in :
brandy grape brandy
fish
mate
pork
rum
sherry
tea
whiskey



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