Diethyl aminoethyl hexanoate

C₁₂H₂₅NO₂CAS 10369-83-2215.34 g/mol

Open in Covalent MOL file

Ester Tertiary amine

Properties

Molecular formula: C₁₂H₂₅NO₂
Molar mass: 215.34 g/mol
Exact mass: 215.1885 Da
logP: 2.45Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 9

Identifiers

CAS number

10369-83-2

SMILES

CCCCCC(=O)OCCN(CC)CC

InChIKey

AEIJVYPRKAWFPN-UHFFFAOYSA-N

InChI

InChI=1S/C12H25NO2/c1-4-7-8-9-12(14)15-11-10-13(5-2)6-3/h4-11H2,1-3H3

Weigh it out

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

Names and synonyms

6 names

Hexanoic acid, 2-(diethylamino)ethyl ester
2-(Diethylamino)ethyl caproate
2-Diethylaminoethyl hexanoate
HKL 4
DA 6
Anxianzhi

Work with Diethyl aminoethyl hexanoate

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

Pentyl hexanoate540-07-866 % similar Propyl hexanoate626-77-766 % similar Butyl hexanoate626-82-466 % similar Butyl laurate106-18-364 % similar Butyl myristate110-36-164 % similar Butyl palmitate111-06-864 % similar Dioctyl adipate123-79-564 % similar Butyl stearate123-95-564 % similar

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

Same formula

12-Aminododecanoic acid693-57-2

Elsewhere

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