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2,7-Bis(4-aminophenyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone

2,7-Bis(4-aminophenyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetraone

Inquiry

Molecular Formula:

C26H16N4O4

Molecular Weight:

448.43

CAS Number:

49546-11-4

Catalog Number:

49546-11-4

Product Information

Molecular Formula:

C26H16N4O4

Molecular Weight:

448.43

Synonyms

Benzo[lmn]?[3,?8]?phenanthroline-?1,?3,?6,?8(2H,?7H)?-?tetrone, 2,?7-?bis(4-?aminophenyl)?-

IUPAC Name

6,13-bis(4-aminophenyl)-6,13-diazatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),2,4(16),8,10-pentaene-5,7,12,14-tetrone

Canonical SMILES

C1=CC(=CC=C1N)N2C(=O)C3=C4C(=CC=C5C4=C(C=C3)C(=O)N(C5=O)C6=CC=C(C=C6)N)C2=O

InChI

InChI=1S/C26H16N4O4/c27-13-1-5-15(6-2-13)29-23(31)17-9-11-19-22-20(12-10-18(21(17)22)24(29)32)26(34)30(25(19)33)16-7-3-14(28)4-8-16/h1-12H,27-28H2

InChI Key

FNEQDBLEMUBBFJ-UHFFFAOYSA-N

Purity

98%

Safety Information

Hazards

H302-H315-H319-H335

Precautionary Statement

P261-P280-P301+P312-P302+P352-P305+P351+P338

GHS Pictogram

GHS07

Signal Word

Warning

Computed Properties

XLogP3

2.9

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

448.117155

Monoisotopic Mass

448.117155

Topological Polar Surface Area

127

Heavy Atom Count

Formal Charge

Complexity

771

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
US-2020217993-A1	Polarizing plate protective film, polarizing plate, and liquid crystal display device	2017-09-29

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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