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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Benzonitrile, 2-amino-4,6-difluoro-

N#Cc1c(N)cc(cc1F)F Request for Quotation
Chemical Name: Benzonitrile, 2-amino-4,6-difluoro-
CAS Number: 190011-84-8
Product Number: AG002E9G(AGN-PC-0NL56H)
Synonyms:
MDL No:
Molecular Formula: C7H4F2N2
Molecular Weight: 154.1169

Identification/Properties

Computed Properties
Molecular Weight:
154.12g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
154.034g/mol
Monoisotopic Mass:
154.034g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
186
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

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Amino-4,6-difluorobenzonitrile is a versatile compound widely utilized in chemical synthesis for its unique properties and reactivity. As a key building block in organic chemistry, this compound plays a crucial role in the development of various pharmaceuticals, agrochemicals, and materials.In chemical synthesis, 2-Amino-4,6-difluorobenzonitrile serves as a valuable intermediate in the production of diverse compounds. It can undergo various functional group transformations, such as nucleophilic substitution, acylation, and condensation reactions, to yield structurally complex molecules. By incorporating this compound into synthetic routes, chemists are able to efficiently access a wide range of target compounds with specific functionalities.One of the key applications of 2-Amino-4,6-difluorobenzonitrile is in medicinal chemistry, where it is used in the synthesis of pharmaceuticals with potential therapeutic effects. Its fluorinated aromatic ring provides enhanced bioactivity and metabolic stability to the final drug molecules. Additionally, the amino and cyano groups present in this compound can serve as anchoring points for further structural modifications to optimize drug properties.Furthermore, 2-Amino-4,6-difluorobenzonitrile finds utility in the development of agrochemicals by enabling the synthesis of novel pesticide and herbicide compounds. Its fluorine atoms confer improved chemical stability and biological activity, making it a valuable component in designing crop protection agents with enhanced effectiveness.Additionally, in materials science, this compound is employed in the synthesis of functional materials and polymers with tailored properties. Its unique structure and reactivity allow for the creation of specialized materials for diverse applications ranging from electronics to coatings.Overall, the versatility and reactivity of 2-Amino-4,6-difluorobenzonitrile make it a valuable tool in chemical synthesis, enabling the efficient construction of complex molecules for various industrial sectors.