CAS 58139-59-6 2,2'-Diamino-4,4'-bithiazole - Catalysts / Alfa Chemistry

Synonyms

4,4'-Bi(thiazole-2-amine); 4,4'-Bi[2-aminothiazole]

IUPAC Name

4-(2-amino-1,3-thiazol-4-yl)-1,3-thiazol-2-amine

Molecular Weight

198.27

Molecular Formula

C6H6N4S2

Canonical SMILES

C1=C(N=C(S1)N)C2=CSC(=N2)N

InChI

MRFMTBTUKQIBDI-UHFFFAOYSA-N

InChI Key

InChI=1S/C6H6N4S2/c7-5-9-3(1-11-5)4-2-12-6(8)10-4/h1-2H,(H2,7,9)(H2,8,10)

Boiling Point

499.8±20.0 °C(Predicted)

Melting Point

237-240 °C (decomp)

Purity

>98.0%(T)(HPLC)

Density

1.590±0.06 g/cm3(Predicted)

Appearance

White to Almost white powder to crystal

Storage

Store under inert gas

Complexity

150

Covalently-Bonded Unit Count

Exact Mass

198.00338856

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

MDL Number

MFCD01740587

Monoisotopic Mass

198.00338856

Refractive Index

1.62

Rotatable Bond Count

Topological Polar Surface Area

134 Å²

Application

2,2'-Diamino-4,4'-bithiazole serves as a versatile compound that combines the characteristics of both an organosulfide and an amine. Its purpose lies in its dual chemical nature, enabling applications where both sulfide and amine functionalities are advantageous. As an organosulfide, it is reactive, particularly with acids, isocyanates, and halocarbons, which could lead to heat generation or hydrogen gas release. Simultaneously, as an amine, 2,2'-Diamino-4,4'-bithiazole acts as a base, neutralizing acids to form salts and water during exothermic reactions. Its unique dual reactivity makes it suitable for use in areas requiring chemical synthesis, material development, or research, while necessitating careful handling due to its potential reactivity with a range of substances such as hydrides and halogenated organics.

February 18, 2025

Excellent Compound for Synthetic Applications

I used 2,2'-Diamino-4,4'-bithiazole from Alfa Chemistry for synthesizing organosulfide-based materials. Its stability and reactivity were perfect for our lab protocols, providing reliable results in complex reactions. Highly recommend it for research use!