chempirical

3-[(2-Ethylhexyl)oxy]-1-propanamine

C11H25NOCAS 5397-31-9187.33 g/mol

Open in Covalent MOL file
ONH2
EtherPrimary amine

Properties

Molecular formula
C11H25NO
Molar mass
187.33 g/mol
Exact mass
187.1936 Da
Boiling point
74–77 °C (at 0.5 Torr)
logP
2.57Crippen estimate
Polar surface area
35.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
9

Identifiers

CAS number
5397-31-9
SMILES
CCCCC(CC)COCCCN
InChIKey
DVFGEIYOLIFSRX-UHFFFAOYSA-N
InChI
InChI=1S/C11H25NO/c1-3-5-7-11(4-2)10-13-9-6-8-12/h11H,3-10,12H2,1-2H3

Weigh it out

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

Names and synonyms

11 names
  • 1-Propanamine, 3-[(2-ethylhexyl)oxy]-
  • Propylamine, 3-[(2-ethylhexyl)oxy]-
  • 2-Ethylhexyl 3-aminopropyl ether
  • 3-(2-Ethylhexoxy)propylamine
  • 3-(2-Ethylhexyloxy)propylamine
  • 3-(2-Ethylhexyloxy)-1-propanamine
  • 3-Aminopropyl 2-ethylhexyl ether
  • PA 12EH
  • NSC 1078
  • Tomamine PA 12EH
  • 2-Ethylhexyloxypropylamine

Work with 3-[(2-Ethylhexyl)oxy]-1-propanamine

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

Di(2-ethylhexyl)ether10143-60-968 % similar 3-Butoxy-1-propanamine16499-88-057 % similar 2-Ethylhexyl glycidyl ether2461-15-656 % similar 2-Ethylhexylamine104-75-653 % similar 3-(Dodecyloxy)propylamine7617-74-553 % similar Ethylhexylglycerin70445-33-951 % similar Silicic acid (H4sio4) tetrakis(2-ethylhexyl) ester115-82-250 % similar Tris(2-ethylhexyl) phosphate78-42-250 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook