2,4-Hexadienoic acid, potassium salt (1:1)

C₆H₇KO₂CAS 590-00-1150.22 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid

Properties

Molecular formula: C₆H₇KO₂
Molar mass: 150.22 g/mol
Exact mass: 150.0083 Da
Density: 1.363 g/mL (at 25 °C)
Melting point: 270 °C
logP: 0.82Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Identifiers

CAS number

590-00-1

SMILES

CC=CC=CC([O-])=O.[K+]

InChIKey

OXPHNMOARHEBGH-UHFFFAOYSA-N

InChI

InChI=1S/C6H8O2.K/c1-2-3-4-5-6(7)8;/h2-5H,1H3,(H,7,8);

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

1 names

2,4-Hexadienoic acid, potassium salt

Work with 2,4-Hexadienoic acid, potassium salt (1:1)

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Calcium sorbate7492-55-976 % similar Sodium sorbate7757-81-576 % similar Potassium acrylate10192-85-543 % similar Potassium polyacrylate25608-12-243 % similar Iron(II) fumarate141-01-542 % similar Disodium fumarate17013-01-342 % similar Calcium fumarate19855-56-242 % similar Disodium maleate371-47-142 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Potassium sorbate24634-61-5

Elsewhere

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