magnolol
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Notes :
Component of Magnolia obovata Thunb..
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol
InChI :InChI=1/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
InChIKey :VVOAZFWZEDHOOU-UHFFFAOYAE
SMILES :C=CCC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)CC=C)O
cas number :528-43-8
fema number :4559
molar refractivity :82.42 ± 0.3 cm3
parachor :621.4 ± 4.0 cm3
index of refraction :1.601 ± 0.02
surface tension :44.6 ± 3.0 dyne/cm
density :1.107 ± 0.06 g/cm3
polarizability :32.67 ± 0.5 10-24cm3
XlogP : 5.30
XlogP3-AA : 5.00
molecular weight : 266.3343200 (IUPAC)
formula :C18 H18 O2
BioActivity Analysis :26755254
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Sigma-Aldrich-Sigma :Magnolol
≥95% (HPLC), from plant
Xi'an Honson :Magnolol

organoleptics :

properties :
appearence :white crystalline powder
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 398.00 to 400.00 °C. @ 760.00 mm Hg
flash point : 364.00  °F.  TCC  ( 184.44 °C. )
logP (o/w) : 3.94
shelf life : 12.00 month(s) or longer if stored properly.
storage :refrigerate in tightly sealed containers.

safety :
most important hazard(s) :Xi N - Irritant, Dangerous for the environment.
  R 37/38 - Irritating to respiratory system and skin.
R 41 - Risk of serious damage to eyes.
R 51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
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 39 - Wear eye/face protection.
S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet.
Oral Toxicity(LD50) :
  Oral-Mouse    2200.00  mg/kg
British Patent Document. Vol. #5135746

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

safety in use :
 
recommendation for magnolol fragrance usage levels up to :
 not for fragrance use.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA on the "LIBRARY" link.
publication number : 24
 average usual ppmaverage maximum ppm
baked goods : --
beverages(nonalcoholic) : --
beverages(alcoholic) : --
breakfast cereal : --
cheese : --
chewing gum : 2000.000002000.00000
condiments / relishes : --
confectionery froastings : --
egg products : --
fats / oils : --
fish products : --
frozen dairy : --
fruit ices : --
gelatins / puddings : --
granulated sugar : --
gravies : --
hard candy : 2000.000002000.00000
imitation dairy : --
instant coffee / tea : --
jams / jellies : --
meat products : --
milk products : --
nut products : --
other grains : --
poultry : --
processed fruits : --
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : --
snack foods : --
soft candy : --
soups : --
sugar substitutes : --
sweet sauces : --

safety references :
EPI System :view
Cancer Citations :Search
Toxicology Citations :Search
Env. Mutagen Info. Center :Search
WISER :UN 3077
 
WGK Germany :3
 
 
 
 
2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol
RTECS :DV5105500 for cas# 528-43-8
chemidplus :000528438
EPA Substance Registry Services :528-43-8
dtp/nci :293099

references :
 
2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol
pubchem :214564

Cosmetics :
Cosmetic uses : antioxidants
bleaching agents

other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
synonyms :
4-allyl-2-(5-allyl-2-hydroxyphenyl) phenol
2,2'-bichavicol
 dehydrodichavicol
5,5'-di-2-propenyl-[1,1'-biphenyl]-2,2'-diol
5,5'-diallyl-2,2'-biphenyl diol
5,5'-diallyl-2,2'-dihydroxybiphenyl
2,2'-dihydroxy-5,5'-diallyl biphenyl
2-(2-hydroxy-5-prop-2-enyl phenyl)-4-prop-2-enyl phenol
2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphenol
 magnolia bark extract

stability :

natural occurrence in :
 found in nature  



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