Benzenemethanol, 2,4,5-trifluoro-


Chemical Name: Benzenemethanol, 2,4,5-trifluoro-
CAS Number: 144284-25-3
Product Number: AG001J81(AGN-PC-0KKXYA)
Synonyms:
MDL No: MFCD00061206
Molecular Formula: C7H5F3O
Molecular Weight: 162.1092

Identification/Properties


Properties
MP:
24℃
BP:
192.5°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
n20/D 1.472(lit.)
Computed Properties
Molecular Weight:
162.111g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
162.029g/mol
Monoisotopic Mass:
162.029g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
131
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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NMR Spectrum


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Chemical Structure



2,4,5-Trifluorobenzyl alcohol is a valuable compound widely used in chemical synthesis as a versatile building block. Its trifluoromethyl group imparts unique chemical and physical properties, making it an important intermediate in the production of various pharmaceuticals, agrochemicals, and organic materials. In organic synthesis, 2,4,5-Trifluorobenzyl alcohol can serve as a precursor for the introduction of the trifluoromethyl group into other molecules, facilitating the synthesis of complex organic compounds with enhanced bioactivity or improved properties. Additionally, its reactivity allows for selective functionalization, enabling the modification of specific positions in target molecules with precision. The presence of the trifluoromethyl group can also influence the overall molecular structure and interactions, leading to potential applications in medicinal chemistry, materials science, and other fields requiring specialized organic compounds.