Tris(4-formylphenyl)amine
Catalog Number
ACM119001433-2
CAS
119001-43-3
IUPAC Name
4-(4-Formyl-N-(4-formylphenyl)anilino)benzaldehyde
Synonyms
4-[Bis(4-formylphenyl)amino]benzaldehyde
Application
Used in preparation of triangular ligands for self-assembly into M4L4 tetrahedra.
Molecular Weight
329.3
Molecular Formula
C21H15NO3
Product Information
Canonical SMILES
C1=CC(=CC=C1C=O)N(C2=CC=C(C=C2)C=O)C3=CC=C(C=C3)C=O
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
Boiling Point
551.1±45.0 °C/760mmHg (lit.)
Melting Point
244-248 °C
Flash Point
257.3±21.1 °C
Purity
95%+
Density
1.3±0.1 g/cm³
Appearance
Solid
Storage
Under inert gas (nitrogen or Argon) at 2-8 °C
Complexity
376
Covalently-Bonded Unit Count
1
Exact Mass
329.10519334
Heavy Atom Count
25
MDL Number
MFCD08276437
Monoisotopic Mass
329.10519334
Refractive Index
n20/D 1.714 (lit.)
Rotatable Bond Count
6
Topological Polar Surface Area
54.4 Ų
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