dipropyl adipate
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IUPAC name :dipropyl hexanedioate
InChI :InChI=1/C12H22O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-10H2,1-2H3
InChIKey :NKOUWLLFHNBUDW-UHFFFAOYAP
SMILES :CCCOC(=O)CCCCC(=O)OCCC
cas number :106-19-4
(EINECS) number :203-371-9
beilstein number :1785512
fema number :4473
molar refractivity :61.19 ± 0.3 cm3
parachor :559.0 ± 4.0 cm3
index of refraction :1.436 ± 0.02
surface tension :32.8 ± 3.0 dyne/cm
density :0.985 ± 0.06 g/cm3
polarizability :24.25 ± 0.5 10-24cm3
XlogP : 2.20
molecular weight : 230.3006800
formula :C12 H22 O4
BioActivity Analysis :71092
NMR Predictor :Predict
 
 
export tariff code :unspecified
fda reg :unspecified

Suppliers :
Inoue :DIPROPYL ADIPATE
Tokyo Chemical Industry :Dipropyl Adipate
>99.0%(GC)

organoleptics :

properties :
Food Chemicals Codex Listed :No
boiling point : 273.00 to 274.00 °C. @ 760.00 mm Hg
flash point : 253.00  °F.  TCC  ( 122.78 °C. )
logP (o/w) : 3.35

safety :
Oral Toxicity(LD50) :
  Intraperitoneal-Rat    3786.00  ul/kg

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

safety in use :
 
recommendation for dipropyl adipate 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 : 556.00000600.00000
beverages(nonalcoholic) : 0.100002.00000
beverages(alcoholic) : --
breakfast cereal : --
cheese : --
chewing gum : --
condiments / relishes : --
confectionery froastings : --
egg products : --
fats / oils : --
fish products : --
frozen dairy : --
fruit ices : --
gelatins / puddings : --
granulated sugar : --
gravies : --
hard candy : --
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
NLM Developmental and Reproductive Toxicity :Search
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :1
 
 
 
 dipropyl hexanedioate
(EINECS) number :203-371-9
chemidplus :000106194
EPA Substance Registry Services :106-19-4
dtp/nci :4894

references :
 dipropyl hexanedioate
NIST Chemistry WebBook :487745993
pubchem :150882

Cosmetics :
Cosmetic uses : emollients
skin conditioning
solvents

other :
CosIng :cosmetic data
synonyms :
 adipic acid dipropyl ester
 dipropyl hexane dioate
 dipropyl hexanedioate
 hexane dioic acid dipropyl ester
 hexanedioic acid dipropyl ester

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) used in :
 emollients
 skin conditioning
 solvents

natural occurrence in :
not found in nature



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