Methyl ricinoleate

C₁₉H₃₆O₃CAS 141-24-2312.49 g/mol

Open in Covalent MOL file

Alcohol Alkene Ester

Properties

Molecular formula: C₁₉H₃₆O₃
Molar mass: 312.49 g/mol
Exact mass: 312.2664 Da
Density: 0.9236 g/mL (at 22 °C)
Melting point: −4.5 °C
Boiling point: 245 °C (at 10 Torr)
logP: 5.17Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 15
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

141-24-2

SMILES

CCCCCC[C@@H](O)C/C=CCCCCCCCC(=O)OC

InChIKey

XKGDWZQXVZSXAO-ADYSOMBNSA-N

InChI

InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-/t18-/m1/s1

Weigh it out

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

Names and synonyms

16 names · show all

9-Octadecenoic acid, 12-hydroxy-, methyl ester, (9Z,12R)-
Ricinoleic acid, methyl ester
9-Octadecenoic acid, 12-hydroxy-, methyl ester, [R-(Z)]-
Flexricin P 1
cis-Ricinoleic acid methyl ester
Methyl 12-D-hydroxy-9-cis-octadecenoate
Methyl ricinate
Ricinic acid methyl ester
NSC 1254
Edenor me-ri 90
K-PON 180
K-PON 180HP
Ricinoleic methyl ester
Methyl (R)-ricinoleate
Methyl cis-(R)-12-hydroxyoctadec-9-enoate
Radia 7081

Work with Methyl ricinoleate

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

Butyl ricinoleate151-13-376 % similar Ethyl (9Z,12R)-12-hydroxy-9-octadecenoate55066-53-076 % similar Methyl 12-hydroxystearate141-23-176 % similar Methyl oleate112-62-970 % similar Methyl palmitoleate1120-25-870 % similar Methyl erucate1120-34-970 % similar Methyl elaidate1937-62-870 % similar Ricinoleic acid141-22-070 % similar

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

Elsewhere

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