chempirical

Isooctyl palmitate

C24H48O2CAS 1341-38-4368.65 g/mol

Open in Covalent MOL file
OO
Ester

Properties

Molecular formula
C24H48O2
Molar mass
368.65 g/mol
Exact mass
368.3654 Da
logP
8.23Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
20

Identifiers

CAS number
1341-38-4
SMILES
CCCCCCCCCCCCCCCC(=O)OCCCCCC(C)C
InChIKey
CJSPFDQEYQBDNN-UHFFFAOYSA-N
InChI
InChI=1S/C24H48O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24(25)26-22-19-16-17-20-23(2)3/h23H,4-22H2,1-3H3

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

Names and synonyms

4 names
  • Hexadecanoic acid, isooctyl ester
  • Palmitic acid, isooctyl ester
  • O 16
  • Nikkol IOP

Work with Isooctyl 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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Isodecyl pelargonate109-32-0100 % similar Isoamyl octanoate2035-99-682 % similar Isoamyl laurate6309-51-982 % similar Isoamyl hexanoate2198-61-079 % similar Dioctyl adipate123-79-575 % similar Decyl decanoate1654-86-075 % similar Dioctyl decanedioate2432-87-375 % similar Stearyl stearate2778-96-375 % similar

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

Same formula

Ethylhexyl palmitate29806-73-3 Lignoceric acid557-59-5

Elsewhere

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