chempirical

1,3-Bis(4-aminophenoxy)benzene

C18H16N2O2CAS 2479-46-1292.34 g/mol

Open in Covalent MOL file
H2NOOH2N
EtherPrimary amine

Properties

Molecular formula
C18H16N2O2
Molar mass
292.34 g/mol
Exact mass
292.1212 Da
Melting point
114–116 °C
logP
4.44Crippen estimate
Polar surface area
70.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4

Identifiers

CAS number
2479-46-1
SMILES
Nc1ccc(Oc2cccc(Oc3ccc(N)cc3)c2)cc1
InChIKey
WUPRYUDHUFLKFL-UHFFFAOYSA-N
InChI
InChI=1S/C18H16N2O2/c19-13-4-8-15(9-5-13)21-17-2-1-3-18(12-17)22-16-10-6-14(20)7-11-16/h1-12H,19-20H2

Weigh it out

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

Names and synonyms

14 names · show all
  • Benzenamine, 4,4′-[1,3-phenylenebis(oxy)]bis-
  • Aniline, 4,4′-(m-phenylenedioxy)di-
  • 4,4′-[1,3-Phenylenebis(oxy)]bis[benzenamine]
  • 1,3-Phenylene bis(p-aminophenyl) ether
  • m-Bis(p-aminophenoxy)benzene
  • 4,4′-(m-Phenylenedioxy)dianiline
  • TPE-R
  • RODA
  • 4,4′-[1,3-Phenylenebis(oxy)]dianiline
  • 1,3-Bis(p-aminophenoxy)benzene
  • 4,4′-(1,3-Phenylenedioxy)dianiline
  • 1,3-Bis(4′-aminophenoxy)benzene
  • [4-[3-(4-Aminophenoxy)phenoxy]phenyl]amine
  • APB 134

Work with 1,3-Bis(4-aminophenoxy)benzene

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

3,4′-Diaminodiphenyl ether2657-87-683 % similar 1,3,5-Tris(4-aminophenoxy)benzene (135tapob)102852-92-677 % similar (4-Aminophenoxy)benzene139-59-374 % similar 4,4'-Oxydianiline101-80-471 % similar 3,3′-Diaminodiphenyl ether15268-07-267 % similar 3-Phenoxybenzenamine3586-12-765 % similar 4,4'-Bis(4-aminophenoxy)biphenyl13080-85-863 % similar 4-(4-Chlorophenoxy)benzenamine101-79-162 % similar

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

Same formula

1,3-Bis(3-aminophenoxy)benzene10526-07-5 4,4′-[1,4-Phenylenebis(oxy)]bis[benzenamine]3491-12-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook