Benzenamine, 3-(difluoromethoxy)-


Chemical Name: Benzenamine, 3-(difluoromethoxy)-
CAS Number: 22236-08-4
Product Number: AG003I7M(AGN-PC-0KKVX9)
Synonyms:
MDL No:
Molecular Formula: C7H7F2NO
Molecular Weight: 159.1334

Identification/Properties


Properties
BP:
201-202°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Stability:
Air Sensitive
Refractive Index:
n20/D 1.5100(lit.)
Computed Properties
Molecular Weight:
159.136g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
159.05g/mol
Monoisotopic Mass:
159.05g/mol
Topological Polar Surface Area:
35.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
121
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



3-(Difluoromethoxy)aniline, also known as DFM aniline, is a versatile chemical compound that finds wide application in chemical synthesis. One noteworthy application of 3-(Difluoromethoxy)aniline is its use as a key building block in the synthesis of various pharmaceuticals and agrochemicals. Due to the unique properties of the difluoromethoxy group, this compound plays a crucial role in the development of novel drug candidates and crop protection agents. Additionally, 3-(Difluoromethoxy)aniline serves as a valuable intermediate in the synthesis of organic compounds used in materials science and medicinal chemistry. Its ability to introduce fluorine atoms into molecular structures makes it a valuable tool for enhancing the bioactivity and chemical properties of target molecules. Furthermore, the presence of the aniline moiety in 3-(Difluoromethoxy)aniline offers opportunities for further functionalization through diverse chemical transformations, enabling the synthesis of complex molecules with tailored properties. In summary, the versatile nature of 3-(Difluoromethoxy)aniline makes it a valuable building block in the field of chemical synthesis, particularly in the development of advanced pharmaceuticals and agrochemicals.