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Structure

Tricarballylic Acid

CAS
99-14-9
Catalog Number
ACM99149
Category
Other Products
Molecular Weight
176.12
Molecular Formula
C6H8O6

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Specification

Synonyms
3-Carboxyglutaric acid
IUPAC Name
Propane-1,2,3-tricarboxylic acid
Canonical SMILES
C(C(CC(=O)O)C(=O)O)C(=O)O
InChI
InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChI Key
KQTIIICEAUMSDG-UHFFFAOYSA-N
Boiling Point
227.71 °C
Melting Point
156-161 °C(lit.)
Flash Point
129.2 °C
Density
1.3744 g/cm³
Appearance
Solid
Storage
Store below +30 °C
Complexity
192
Exact Mass
176.03208797
Monoisotopic Mass
176.03208797
Refractive Index
1.5860
Topological Polar Surface Area
112 Ų
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