chempirical

4,4′,4′′-Methylidynetris[benzenamine]

C19H19N3CAS 548-61-8289.38 g/mol

Open in Covalent MOL file
NH2H2NNH2
Primary amine

Properties

Molecular formula
C19H19N3
Molar mass
289.38 g/mol
Exact mass
289.1579 Da
Melting point
207–208.5 °C
logP
3.61Crippen estimate
Polar surface area
78.1 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3

Identifiers

CAS number
548-61-8
SMILES
Nc1ccc(C(c2ccc(N)cc2)c2ccc(N)cc2)cc1
InChIKey
ADUMIBSPEHFSLA-UHFFFAOYSA-N
InChI
InChI=1S/C19H19N3/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,19H,20-22H2

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Names and synonyms

14 names · show all
  • Benzenamine, 4,4′,4′′-methylidynetris-
  • Aniline, 4,4′,4′′-methylidynetri-
  • Leucoparafuchsine
  • C.I. Basic Red 9, leuco-
  • Leucoparafuchsin
  • Tris(4-aminophenyl)methane
  • 4,4′,4′′-Methylidynetrianiline
  • p,p′,p′′-Triaminotriphenylmethane
  • 4,4′,4′′-Triaminotriphenylmethane
  • Leucopararosaniline
  • Pararosaniline, leuco base
  • Tris(p-aminophenyl)methane
  • Pararosaniline base
  • 4,4′,4′′-Methylidenetris(benzenamine)

Work with 4,4′,4′′-Methylidynetris[benzenamine]

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

P-Phenylenediamine106-50-360 % similar 4-Isopropylaniline99-88-757 % similar 4-Amino-α-methylbenzenemethanol14572-89-550 % similar 1,4-Diaminobenzene dihydrochloride624-18-050 % similar 4-Cyclohexylbenzenamine6373-50-850 % similar Benzidine92-87-550 % similar 4-(1-Methylpropyl)benzenamine30273-11-146 % similar 4,4′-Ethylenedianiline621-95-445 % similar

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

Elsewhere

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