trans-10-cis-12-Octadecadienoic acid

C₁₈H₃₂O₂CAS 2420-56-6280.45 g/mol

Open in Covalent MOL file

Alkene Carboxylic acid

Properties

Molecular formula: C₁₈H₃₂O₂
Molar mass: 280.45 g/mol
Exact mass: 280.2402 Da
logP: 5.88Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 14

Identifiers

CAS number

2420-56-6

SMILES

CCCCC/C=CC=CCCCCCCCCC(=O)O

InChIKey

GKJZMAHZJGSBKD-NMMTYZSQSA-N

InChI

InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-9H,2-5,10-17H2,1H3,(H,19,20)/b7-6-,9-8+

Weigh it out

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

Names and synonyms

9 names

10,12-Octadecadienoic acid, (10E,12Z)-
10,12-Octadecadienoic acid, (Z,E)-
(10E,12Z)-10,12-Octadecadienoic acid
10-trans-12-cis-Octadecadienoic acid
10E,12Z-Octadecadienoic acid
10-Trans,12-cis-Linoleic acid
trans-10,cis-12 Conjugated linoleic acid
10t12c Conjugated linoleic acid
C18:2 t-10,c-12

Work with trans-10-cis-12-Octadecadienoic 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

Elaidic acid112-79-887 % similar Oleic acid112-80-187 % similar Erucic acid112-86-787 % similar Palmitoleic acid373-49-987 % similar 9-Eicosenoic acid506-31-087 % similar Brassidic acid506-33-287 % similar Nervonic acid506-37-687 % similar 11-Eicosenoic acid5561-99-987 % similar

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

Same formula

17-Octadecynoic acid34450-18-5 Stearolic acid506-24-1 Linoleic acid60-33-3 (Trans,trans)-4′-pentyl[1,1′-bicyclohexyl]-4-carboxylic acid65355-33-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook