4,4'-((Propane-2,2-diylbis(4,1-phenylene))bis(oxy))diphthalonitrile

Product Information

Molecular Formula:
C31H20N4O2
Molecular Weight:
480.52
Synonyms
4-(4-(1-(4-(3,4-Dicyanophenoxy)phenyl)-1-methylethyl)phenoxy)phthalonitrile; 4,4'-((Propane-2,2-diylbis(4,1-phenylene))bis(oxy))diphthalonitrile; 4-(4-{1-[4-(3,4-dicyanophenoxy)phenyl]-1-methylethyl}phenoxy)phthalonitrile; 2,2-bis[4-(3,4-dicyanophenoxy)phenyl]propane; 2,2-bis[4-(3,4-dicyanophenoxy)phenyl] propane; 4-[4-[1-[4-(3,4-dicyanophenoxy)phenyl]-1-methyl-ethyl]phenoxy]phthalonitrile
IUPAC Name
4-[4-[2-[4-(3,4-dicyanophenoxy)phenyl]propan-2-yl]phenoxy]benzene-1,2-dicarbonitrile
Canonical SMILES
CC(C)(C1=CC=C(C=C1)OC2=CC(=C(C=C2)C#N)C#N)C3=CC=C(C=C3)OC4=CC(=C(C=C4)C#N)C#N
InChI
InChI=1S/C31H20N4O2/c1-31(2,25-5-11-27(12-6-25)36-29-9-3-21(17-32)23(15-29)19-34)26-7-13-28(14-8-26)37-30-10-4-22(18-33)24(16-30)20-35/h3-16H,1-2H3
InChI Key
JHYUOAPCMWCEND-UHFFFAOYSA-N
Purity
97%

Computed Properties

XLogP3
6.7
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
6
Exact Mass
480.15862589
Monoisotopic Mass
480.15862589
Topological Polar Surface Area
114
Heavy Atom Count
37
Formal Charge
0
Complexity
892
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021087197-A1 Curable compositions of benzoxazine and phthalonitrile resins 2019-10-31
US-2022403108-A1 Curable Compositions Of Benzoxazine And Phthalonitrile Resins 2019-10-31
RU-2712547-C1 Reactive thinner of phthalonitrile resins and thermosetting composition based thereon 2018-12-29
EP-3396183-A1 Bearing including a phthalonitrile-based polymer material 2017-04-26
US-2018313405-A1 Bearing including a phthalonitrile-based polymer material 2017-04-26
US-2016168327-A1 Controlling crosslinking density and processing parameters ofnphthalonitriles 2014-12-15
US-2017001357-A1 Controlling crosslinking density and processing parameters of phthalonitriles 2014-12-15
US-2017002146-A1 Controlling crosslinking density and processing parameters of phthalonitriles 2014-12-15
US-9464170-B2 Controlling crosslinking density and processing parameters of phthalonitriles 2014-12-15
US-9815235-B2 Controlling crosslinking density and processing parameters of phthalonitriles 2014-12-15
The molarity calculator equation

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

The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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