chempirical

4-Ethylaniline

C8H11NCAS 589-16-2121.18 g/mol

Open in Covalent MOL file
NH2
Primary amine

Properties

Molecular formula
C8H11N
Molar mass
121.18 g/mol
Exact mass
121.0891 Da
Density
0.969 g/mL (at 20 °C)
Melting point
−4.8 °C
Boiling point
217.5 °C
logP
1.83Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
589-16-2
SMILES
CCc1ccc(N)cc1
InChIKey
HRXZRAXKKNUKRF-UHFFFAOYSA-N
InChI
InChI=1S/C8H11N/c1-2-7-3-5-8(9)6-4-7/h3-6H,2,9H2,1H3

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

Names and synonyms

8 names
  • Benzenamine, 4-ethyl-
  • Aniline, p-ethyl-
  • 4-Ethylbenzenamine
  • p-Ethylaniline
  • 4-Aminoethylbenzene
  • 4-Ethylphenylamine
  • p-Ethylaminobenzene
  • NSC 62015

Work with 4-Ethylaniline

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

1,4-Diethylbenzene105-05-567 % similar 4-Propylaniline2696-84-661 % similar 4,4′-Ethylenedianiline621-95-460 % similar 4,4'-Methylenedianiline101-77-957 % similar 4-Butylaniline104-13-256 % similar 4-Amino-N,N-dimethylbenzenemethanamine6406-74-256 % similar 4-Pentylaniline33228-44-354 % similar 3-Ethylaniline587-02-054 % similar

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

Same formula

3-Methylbenzylamine100-81-2 N-Methylbenzylamine103-67-3 N-Ethylaniline103-69-5 4-Methylbenzylamine104-84-7 5-Ethyl-2-methylpyridine104-90-5 3,5-Xylidine108-69-0 2,4,6-Trimethylpyridine108-75-8 4-Propylpyridine1122-81-2

Elsewhere

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