ChemicalBook Product Catalog Chemical Reagents Organic reagents fatty acid TRANS-ACONITIC ACID

TRANS-ACONITIC ACID

Chemical Properties

Melting point	190 °C (dec.)(lit.)
Boiling point	225.05°C (rough estimate)
Density	0.56 g/cm3 (20℃)
refractive index	1.5860 (estimate)
FEMA	2010 \| ACONITIC ACID
storage temp.	Store below +30°C.
solubility	400g/l
form	Solid
pka	2.8(at 25℃)
color	White to Off-White
Odor	at 100.00 %. vegetable musty nut dry toasted
PH	3.14(1 mM solution);2.48(10 mM solution);1.92(100 mM solution)
Odor Type	vegetable
Water Solubility	Soluble in water at 20°C 400g/L. Slightly soluble in ether.
BRN	1725830
InChI	1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+
InChIKey	GTZCVFVGUGFEME-HNQUOIGGSA-N
SMILES	OC(=O)C\C(=C/C(O)=O)C(O)=O
LogP	-0.14
CAS DataBase Reference	4023-65-8(CAS DataBase Reference)
EPA Substance Registry System	1-Propene-1,2,3-tricarboxylic acid, (1E)- (4023-65-8)