chempirical

N-Ethyl-4-methylaniline

C9H13NCAS 622-57-1135.21 g/mol

Open in Covalent MOL file
HN
Secondary amine

Properties

Molecular formula
C9H13N
Molar mass
135.21 g/mol
Exact mass
135.1048 Da
Boiling point
217 °C
logP
2.43Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Identifiers

CAS number
622-57-1
SMILES
CCNc1ccc(C)cc1
InChIKey
AASABFUMCBTXRL-UHFFFAOYSA-N
InChI
InChI=1S/C9H13N/c1-3-10-9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3

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

Names and synonyms

9 names
  • Benzenamine, N-ethyl-4-methyl-
  • p-Toluidine, N-ethyl-
  • N-Ethyl-4-methylbenzenamine
  • N-Ethyl-p-toluidine
  • p-Methyl-N-ethylaniline
  • N-Ethyl-p-methylaniline
  • N-Ethyl-4-toluidine
  • NSC 8889
  • 4-(Ethylamino)toluene

Work with N-Ethyl-4-methylaniline

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

N-Ethylaniline103-69-558 % similar 4-Chloro-N-ethylbenzenamine13519-75-058 % similar Bis(4-methylphenyl)amine620-93-952 % similar (4-Methylphenyl)hydrazine539-44-648 % similar N-Methyl-P-toluidine623-08-548 % similar N,N'-Di-(4-methyl-phenyl)-benzidine10311-61-246 % similar N-Ethyl-4-methylbenzenesulfonamide80-39-745 % similar P-Xylene106-42-345 % similar

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

Same formula

N-Ethyl-M-toluidine102-27-2 3,4-Dimethylbenzenemethanamine102-48-7 Dimethylbenzylamine103-83-3 Dimethyl-M-toluidine121-72-2 2,4,5-Trimethylaniline137-17-7 Ethylbenzylamine14321-27-8 2-Propylaniline1821-39-2 (αS)-N,α-Dimethylbenzenemethanamine19131-99-8

Elsewhere

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