Silsesquioxanes,Me

Product Information

Molecular Formula:

C66H56N4

Molecular Weight:

Synonyms

POLY(METHYLSILSESQUIOXANE); Siliconeoilemulsion284P; Silsesquioxanes,me; poly(methylsilsesquioxane),100%methyl; METHYLSILSESQUIOXANE; POLY(METHYLSILSESQUIOXANE): 4.0-6.0% OH; POLY(METHYLSILSESQUIOXANE): 100% METHYL, 2.5-4% OH; POLY(PHENYL-VINYLSILSESQUIOXANE):

IUPAC Name

N'-[1-(4-cyclohexa-1,5-dien-1-ylcyclohexa-1,5-dien-1-yl)-3-(4-phenylphenyl)prop-1-enyl]-4-[9-[6-methyl-5-(2-methylphenyl)cyclohexa-1,5-dien-1-yl]carbazol-3-yl]carbazole-9-carboximidamide

Canonical SMILES

CC1=CC=CC=C1C2=C(C(=CCC2)N3C4=C(C=C(C=C4)C5=C6C7=CC=CC=C7N(C6=CC=C5)C(=NC(=CCC8=CC=C(C=C8)C9=CC=CC=C9)C1=CCC(C=C1)C1=CCCC=C1)N)C1=CC=CC=C13)C

InChI

InChI=1S/C66H56N4/c1-44-17-9-10-22-53(44)54-25-15-29-60(45(54)2)69-61-27-13-11-23-56(61)58-43-52(40-42-63(58)69)55-26-16-30-64-65(55)57-24-12-14-28-62(57)70(64)66(67)68-59(51-38-36-50(37-39-51)48-20-7-4-8-21-48)41-33-46-31-34-49(35-32-46)47-18-5-3-6-19-47/h3,5-7,9-14,16-24,26-32,34-36,38-43,50H,4,8,15,25,33,37H2,1-2H3,(H2,67,68)

InChI Key

IYKSBVLUZFFSST-UHFFFAOYSA-N

Density

1,08 g/cm³

Concentration

100% Methyl

Computed Properties

XLogP3

15.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

904.45049780 g/mol

Monoisotopic Mass

904.45049780 g/mol

Topological Polar Surface Area

48.2Å²

Heavy Atom Count

Formal Charge

Complexity

2100

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

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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Silsesquioxanes,Me

Product Information

Computed Properties

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