chempirical

Ethyl palmitate

C18H36O2CAS 628-97-7284.48 g/mol

Open in Covalent MOL file
OO
Ester

Properties

Molecular formula
C18H36O2
Molar mass
284.48 g/mol
Exact mass
284.2715 Da
Density
0.863–0.865 g/mL
Melting point
24 °C
Boiling point
191 °C
logP
6.03Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
15

Hazards

Not classified as hazardous under GHS by 1,459 ECHA notifiers. Aggregated from 1,459 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
628-97-7
SMILES
CCCCCCCCCCCCCCCC(=O)OCC
InChIKey
XIRNKXNNONJFQO-UHFFFAOYSA-N
InChI
InChI=1S/C18H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h3-17H2,1-2H3

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

Names and synonyms

4 names
  • Hexadecanoic acid, ethyl ester
  • Palmitic acid, ethyl ester
  • Ethyl hexadecanoate
  • NSC 8918

Work with Ethyl palmitate

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Ethyl heptanoate106-30-9100 % similar Ethyl octanoate106-32-1100 % similar Ethyl dodecanoate106-33-2100 % similar Ethyl decanoate110-38-3100 % similar Ethyl stearate111-61-5100 % similar Ethyl nonanoate123-29-5100 % similar Ethyl myristate124-06-1100 % similar Ethyl heptadecanoate14010-23-2100 % similar

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

Same formula

Butyl myristate110-36-1 Methyl heptadecanoate1731-92-6 Isostearic acid2724-58-5 Stearic acid57-11-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia