chempirical

4-Decylaniline

C16H27NCAS 37529-30-9233.40 g/mol

Open in Covalent MOL file
NH2
Primary amine

Properties

Molecular formula
C16H27N
Molar mass
233.40 g/mol
Exact mass
233.2143 Da
Melting point
25 °C
Boiling point
219 °C
logP
4.95Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
9

Identifiers

CAS number
37529-30-9
SMILES
CCCCCCCCCCc1ccc(N)cc1
InChIKey
WGENWPANMZLPIH-UHFFFAOYSA-N
InChI
InChI=1S/C16H27N/c1-2-3-4-5-6-7-8-9-10-15-11-13-16(17)14-12-15/h11-14H,2-10,17H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Benzenamine, 4-decyl-
  • Aniline, p-decyl-
  • 4-Decylbenzenamine
  • p-n-Decylaniline
  • 4-n-Decylaniline
  • p-Decylaniline
  • 4-Decylphenylamine

Work with 4-Decylaniline

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

4-Dodecylaniline104-42-7100 % similar 4-Octylbenzenamine16245-79-7100 % similar 4-Hexylaniline33228-45-4100 % similar 4-Pentylaniline33228-44-396 % similar 4-Butylaniline104-13-283 % similar 4-Propylaniline2696-84-668 % similar Decylbenzene104-72-362 % similar Hexylbenzene1077-16-362 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook