11,14-Eicosadienoic acid

C₂₀H₃₆O₂CAS 2091-39-6308.51 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid

Properties

Molecular formula: C₂₀H₃₆O₂
Molar mass: 308.51 g/mol
Exact mass: 308.2715 Da
Boiling point: 198 °C (at 0.08 Torr)
logP: 6.66Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 16

Identifiers

CAS number

2091-39-6

SMILES

CCCCCC=CCC=CCCCCCCCCCC(=O)O

InChIKey

XSXIVVZCUAHUJO-UHFFFAOYSA-N

InChI

InChI=1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,21,22)

Weigh it out

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

Work with 11,14-Eicosadienoic acid

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

Linoleic acid60-33-3100 % similar Gamma-linolenic acid506-26-397 % similar Arachidonic acid506-32-190 % similar Elaidic acid112-79-890 % similar Oleic acid112-80-190 % similar Erucic acid112-86-790 % similar Palmitoleic acid373-49-990 % similar 9-Eicosenoic acid506-31-090 % similar

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

Same formula

Sclareol515-03-7 Ethyl linoleate544-35-4

Elsewhere

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