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499-12-7

Name propene-1,2,3-tricarboxylic acid
CAS 499-12-7
EINECS(EC#) 207-877-0
Molecular Formula C6H6O6
MDL Number MFCD00063184
Molecular Weight 174.11
MOL File 499-12-7.mol

Chemical Properties

Melting point  192°C (rough estimate)
Boiling point  225.05°C (rough estimate)
density  1.4285 (rough estimate)
FEMA  2010 | ACONITIC ACID
refractive index  1.5860 (estimate)
solubility  Soluble 16 % in water at 13 ℃, 33% in water at 25 ℃. Decomposes when heated to 200° C. Soluble in alcohol and most perfume and flavor materials, poorly soluble in hydrocarbons (Terpenes, etc.).
form  Solid
pka 2.39±0.36(Predicted)
color  Colorless (white) crystal leaves or plates
Odor Vegetative, musty and nutty with a dry, toasted nuance
JECFA Number 627
LogP 0.63
Uses
Aconitic Acid is a flavoring substance which occurs in the leaves and tubers of aconitum napellus l. And other ranunculaceae. Transaconitic acid can be isolated during sugar cane processing, by precipitation as the calcium salt from cane sugar or molasses. It may be synthesized by sulfuric acid dehydration of citric acid but not by the methanesulfonic acid method. It is used in a maximum level, as served, of 0.003% for baked goods, 0.002% for alcoholic beverages, 0.0015% for frozen dairy products, 0.0035% for soft candy, and 0.0005% or less for all other food categories.
EPA Substance Registry System 1-Propene-1,2,3-tricarboxylic acid (499-12-7)

Safety Data

Hazardous Substances Data 499-12-7(Hazardous Substances Data)
Toxicity
LD50 intravenous in mouse: 180mg/kg

Hazard Information

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