Imidodicarbonimidic diamide, N-[3,5-bis(trifluoromethyl)phenyl]-


Chemical Name: Imidodicarbonimidic diamide, N-[3,5-bis(trifluoromethyl)phenyl]-
CAS Number: 36068-40-3
Product Number: AG00BYPV(AGN-PC-0O9BGI)
Synonyms:
MDL No:
Molecular Formula: C10H10ClF6N5
Molecular Weight: 349.6633

Identification/Properties


Properties
MP:
246 °C (dec.)(lit.)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
349.665g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
349.053g/mol
Monoisotopic Mass:
349.053g/mol
Topological Polar Surface Area:
103A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
401
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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Chemical Structure



Derived from the compound 1-[3,5-Bis(trifluoromethyl)phenyl]biguanide hydrochloride, this versatile chemical is commonly used in chemical synthesis applications. Its unique molecular structure allows it to participate in various reactions as a key reagent or catalyst, contributing to the synthesis of complex organic compounds. With its ability to facilitate specific transformations and functional group modifications, 1-[3,5-Bis(trifluoromethyl)phenyl]biguanide hydrochloride plays a crucial role in enabling the preparation of diverse molecular architectures with high efficiency and selectivity.