Ethyl eicosapentaenoate

C₂₂H₃₄O₂CAS 86227-47-6330.51 g/mol

Open in Covalent MOL file

Alkene Ester

Properties

Molecular formula: C₂₂H₃₄O₂
Molar mass: 330.51 g/mol
Exact mass: 330.2559 Da
logP: 6.47Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 14

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin50% of notifiers
H332 Harmful if inhaled50% of notifiers
H410 Very toxic to aquatic life with long lasting effects50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P391, P501

Identifiers

CAS number

86227-47-6

SMILES

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

InChIKey

SSQPWTVBQMWLSZ-AAQCHOMXSA-N

InChI

InChI=1S/C22H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h5-6,8-9,11-12,14-15,17-18H,3-4,7,10,13,16,19-21H2,1-2H3/b6-5-,9-8-,12-11-,15-14-,18-17-

Weigh it out

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

Names and synonyms

17 names · show all

5,8,11,14,17-Eicosapentaenoic acid, ethyl ester, (5Z,8Z,11Z,14Z,17Z)-
5,8,11,14,17-Eicosapentaenoic acid, ethyl ester, (all-Z)-
(All-Z)-5,8,11,14,17-Eicosapentaenoic acid ethyl ester
Epadel
Timnodonic acid ethyl ester
cis-Eicosapentaenoic acid ethyl ester
Ethyl all-cis-5,8,11,14,17-eicosapentaenoate
Icosapent ethyl
AMR 101
Epadel S 300
Vascepa
Incromega EPA
Ethyl icosapentate
(5Z,8Z,11Z,14Z,17Z)-5,8,11,14,17-Eicosapentaenoic acid ethyl ester
Ethyl all-Z-5,8,11,14,17-eicosapentanenoate
C20:5 n-3 Ethyl ester
Ethyl (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoate

Work with Ethyl eicosapentaenoate

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

Ethyl linolenate1191-41-991 % similar Ethyl 4,7,10,13,16,19-docosahexaenoate84494-72-482 % similar Ethyl arachidonate1808-26-077 % similar Ethyl linoleate544-35-470 % similar Methyl linolenate301-00-863 % similar Ethyl oleate111-62-662 % similar Ethyl (E)-4-decenoate76649-16-659 % similar Diethyl glutarate818-38-258 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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