Benzene, 1,1'-oxybis[4-isocyanato-


Chemical Name: Benzene, 1,1'-oxybis[4-isocyanato-
CAS Number: 4128-73-8
Product Number: AG003KDY(AGN-PC-0JL4EM)
Synonyms:
MDL No:
Molecular Formula: C14H8N2O3
Molecular Weight: 252.22492

Identification/Properties


Properties
MP:
64-66°C
Storage:
-10 ℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
252.229g/mol
XLogP3:
5.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
252.053g/mol
Monoisotopic Mass:
252.053g/mol
Topological Polar Surface Area:
68.1A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
334
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

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NMR Spectrum


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Chemical Structure



4,4′-Diisocyanatodiphenyl ether, also known as MDI, is a versatile chemical compound widely used in chemical synthesis for its unique reactive properties. Its application in the synthesis of polyurethane polymers, a class of versatile materials with excellent mechanical properties, is particularly noteworthy. MDI acts as a key building block in the synthesis of polyurethanes through a reaction with polyols, resulting in the formation of flexible, rigid, or foam materials depending on the specific formulation. Additionally, 4,4′-Diisocyanatodiphenyl ether is also utilized in the production of adhesives, coatings, elastomers, and sealants, showcasing its importance in various industrial applications within the chemical synthesis field.