CAS 119001-43-3 | Benzaldehyde, 4,4',4''-nitrilotris- | CAS Number 119001-43-3

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119001-43-3 | Benzaldehyde, 4,4',4''-nitrilotris-

CAS No: 119001-43-3 Catalog No: AG000P1D MDL No:MFCD08276437

Product Description

Catalog Number:

AG000P1D

Chemical Name:

Benzaldehyde, 4,4',4''-nitrilotris-

CAS Number:

119001-43-3

Molecular Formula:

C21H15NO3

Molecular Weight:

329.3487

MDL Number:

MFCD08276437

IUPAC Name:

4-(4-formyl-N-(4-formylphenyl)anilino)benzaldehyde

InChI:

InChI=1S/C21H15NO3/c23-13-16-1-7-19(8-2-16)22(20-9-3-17(14-24)4-10-20)21-11-5-18(15-25)6-12-21/h1-15H

InChI Key:

YOXHQRNDWBRUOL-UHFFFAOYSA-N

SMILES:

O=Cc1ccc(cc1)N(c1ccc(cc1)C=O)c1ccc(cc1)C=O

NSC Number:

28900

Properties

Complexity:

376

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

329.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

329.355g/mol

Monoisotopic Mass:

329.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5

Literature

Title	Journal
Naphthylhydrazone based selective and sensitive chemosensors for Cu2+ and their application in bioimaging.	Dalton transactions (Cambridge, England : 2003) 20121121
4,4'-(Phenyl-imino)dibenzaldehyde.	Acta crystallographica. Section E, Structure reports online 20090901