menthyl propylene glycol carbonate
 
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InChI :InChI=1/C27H50O5/c1-17(2)21-9-11-26(7,13-19(5)28)15-23(21)31-25(30)32-24-16-27(8,14-20(6)29)12-10-22(24)18(3)4/h17-24,28-29H,9-16H2,1-8H3
InChIKey :WMCDUKFXMDINON-UHFFFAOYAX
SMILES :O=C(OC1CC(C)(CCC1C(C)C)CC(C)O)OC2CC(C)(CC(C)O)CCC2C(C)C
eu annex :607-271-00-X
cas number :156324-82-2
fema number :3992
coe number :9843
jecfa number :1413
fl. number :09.920
molar refractivity :129.48 ± 0.4 cm3
parachor :1108.8 ± 6.0 cm3
index of refraction :1.496 ± 0.032
surface tension :39.4 ± 5.0 dyne/cm
density :1.02 ± 0.1 g/cm3
polarizability :51.33 ± 0.5 10-24cm3
molecular weight : 258.3538400
formula :C14 H26 O4
 
 
export tariff code :unspecified
fda reg :unspecified
 

organoleptics :
odor type :minty
odor strength :medium
odor description :
at 100.00 %.  
menthol

properties :
appearence :colorless clear liquid
assay : 87.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.01100 to 1.01700 @ 25.00 °C.
pounds per gallon - calc. : 8.413 to 8.462
refractive index :1.45500 to 1.46100 @ 20.00 °C.
boiling point : 140.00 to 143.00 °C. @ 760.00 mm Hg
acid value : 2.00  max.  KOH/g
logp : 6.82

safety :
most important hazard(s) : Xi - Irritant
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) :not determined
recommendation for menthyl propylene glycol carbonate 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).
publication number : 20.
3992 average usual ppmaverage maximum ppm
baked goods : 60.00000250.00000
beverages(nonalcoholic) : 30.00000120.00000
beverages(alcoholic) : 100.00000400.00000
breakfast cereal : 15.0000060.00000
cheese : 15.0000060.00000
chewing gum : 5000.0000020000.00000
condiments / relishes : 100.00000400.00000
confectionery froastings : 500.000002000.00000
egg products : --
fats / oils : --
fish products : --
frozen dairy : 30.00000120.00000
fruit ices : 100.00000400.00000
gelatins / puddings : 200.00000800.00000
granulated sugar : --
gravies : 25.00000100.00000
hard candy : 500.000002000.00000
imitation dairy : 15.0000060.00000
instant coffee / tea : 100.00000400.00000
jams / jellies : --
meat products : --
milk products : 200.00000800.00000
nut products : --
other grains : --
poultry : --
processed fruits : 100.00000400.00000
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : --
snack foods : 25.00000100.00000
soft candy : 500.000002000.00000
soups : 25.00000100.00000
sugar substitutes : --
sweet sauces : --

safety links :
 
 
chemidplus :156324-82-2
EPA Substance Registry Services :156324-82-2
NLM Chemical Carcinogenesis Research Information System :156324-82-2
NLM Developmental and Reproductive Toxicity :156324-82-2
NLM Env. Mutagen Info. Center :156324-82-2
NLM GENetic TOXicology :156324-82-2
EPI System :view

other :

references :
jecfa number :1413
fl. number :09.920
pubchem :156324-82-2
synonyms :
2-hydroxypropyl menthane-3-yl carbonate
dextro,laevo-menthol(±)-propylene glycol carbonate
 menthyl propylene glycol carbonate
dextro,laevo-menthyl propylene glycol carbonate
2-isopropyl-5-methyl cyclohexyl oxycarbonyl oxy-2-hydroxypropane

soluble in :
 alcohol
 propylene glycol

insoluble in :
 water

(odor and/or flavor) blends with :
 camphene hydrate
dextro-neomenthol
isomenthone
laevo-menthone
laevo-monomenthyl glutarate
 thujyl alcohol
 verbenone
 WS-5

(odor and/or flavor) used in :
 herbal
 mint
 peppermint

natural occurrence in :
not found in nature



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Html Last modified 11/25/2008