4,4′-[[1,1′-Biphenyl]-2,5-Diylbis(Oxy)]Bis[Benzenamine]

CAS: 94148-67-1 | C24H20N2O2

Loading 3D structure...

CAS Registry Number: 94148-67-1

Molecular Formula: C24H20N2O2

Molecular Mass: 368.44 g/mol

4,4′-[[1,1′-Biphenyl]-2,5-Diylbis(Oxy)]Bis[Benzenamine]

Benzenamine, 4,4′-[[1,1′-biphenyl]-2,5-diylbis(oxy)]bis-

4,4′-[[1,1′-Biphenyl]-2,5-diylbis(oxy)]bis[benzenamine]

1,4-Bis(4-aminophenoxy)-2-phenylbenzene

4,4′-[(2-Phenyl-p-phenylene)dioxy]dianiline

2,5-Bis(4-aminophenoxy)biphenyl

Nc1ccc(Oc2ccc(Oc3ccc(N)cc3)c(-c3ccccc3)c2)cc1

InChI=1S/C24H20N2O2/c25-18-6-10-20(11-7-18)27-22-14-15-24(28-21-12-8-19(26)9-13-21)23(16-22)17-4-2-1-3-5-17/h1-16H,25-26H2

NMR, IR, and Mass spectral data

1H NMR

13C NMR

Predicting NMR spectra...

10 ppm 9 8 7 6 5 4 3 2 1 0 ppm

Shift (ppm)	Multiplicity	Integration	Assignment

200 ppm 180 160 140 120 100 80 60 40 20 0 ppm

Shift (ppm)	DEPT	Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

Comprehensive physical and chemical properties

Property	Value	Source
Molecular Mass	368.44 g/mol	CAS Common Chemistry
	368.43600000000004 g/mol	RDKit
	368.15247788 g/mol	RDKit
Canonical SMILES	O(C1=CC=C(N)C=C1)C=2C=CC(OC3=CC=C(N)C=C3)=C(C2)C=4C=CC=CC4	CAS Common Chemistry
InChI	InChI=1S/C24H20N2O2/c25-18-6-10-20(11-7-18)27-22-14-15-24(28-21-12-8-19(26)9-13-21)23(16-22)17-4-2-1-3-5-17/h1-16H,25-26H2	CAS Common Chemistry
InChI Key	InChIKey=JWRLKLYWXKMAFL-UHFFFAOYSA-N	CAS Common Chemistry
Name	4,4′-[[1,1′-Biphenyl]-2,5-diylbis(oxy)]bis[benzenamine]	CAS Common Chemistry
Heavy Atom Count	28	RDKit
Hydrogen Bond Acceptors	4	RDKit
Hydrogen Bond Donors	2	RDKit
Rotatable Bonds	5	RDKit
Aromatic Ring Count	4	RDKit
Topological Polar Surface Area	70.5 Å²	RDKit
LogP	6.102600000000004	RDKit
Molar Refractivity	113.73479999999999	RDKit