[6-(difluoromethoxy)-2H-1,3-benzodioxol-5-yl]methanamine


Chemical Name: [6-(difluoromethoxy)-2H-1,3-benzodioxol-5-yl]methanamine
CAS Number: 1250675-73-0
Product Number: AG019ZG7(AGN-PC-0WO2YY)
Synonyms:
MDL No: MFCD16061311
Molecular Formula: C9H9F2NO3
Molecular Weight: 217.1695

Identification/Properties


Computed Properties
Molecular Weight:
217.172g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
217.055g/mol
Monoisotopic Mass:
217.055g/mol
Topological Polar Surface Area:
53.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
218
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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Chemical Structure



The compound [6-(difluoromethoxy)-2H-1,3-benzodioxol-5-yl]methanamine plays a crucial role in chemical synthesis due to its unique structural properties. With its difluoromethoxy group attached to the benzodioxol ring, this compound serves as a versatile building block in the creation of various pharmaceuticals, agrochemicals, and materials. In organic chemistry, it can be utilized as a precursor in the synthesis of complex molecules through processes such as nucleophilic substitution and reductive amination. The presence of the difluoromethoxy group enhances the compound's reactivity and stability, making it a valuable tool for the development of novel compounds with potential applications in drug discovery and material science.