3-Chloro-4-(trifluoromethoxy)benzyl alcohol


Chemical Name: 3-Chloro-4-(trifluoromethoxy)benzyl alcohol
CAS Number: 56456-48-5
Product Number: AG003AXY(AGN-PC-0KKVQG)
Synonyms:
MDL No:
Molecular Formula: C8H6ClF3O2
Molecular Weight: 226.5802

Identification/Properties


Properties
BP:
236.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
226.579g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
226.001g/mol
Monoisotopic Mass:
226.001g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
14
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

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NMR Spectrum


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Chemical Structure



The compound 3-Chloro-4-(trifluoromethoxy)phenyl)methanol is a versatile building block in chemical synthesis. It is commonly used as a key intermediate in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Due to its unique structure, this compound can act as a starting material for the synthesis of various complex organic molecules. Its functional groups enable it to participate in a range of chemical reactions, including nucleophilic substitution, oxidation, and reduction reactions. Additionally, the presence of the chloro and trifluoromethoxy substituents on the phenyl ring provides opportunities for further functionalization, leading to the creation of diverse chemical products. In summary, the application of 3-Chloro-4-(trifluoromethoxy)phenyl)methanol in chemical synthesis offers a valuable tool for the development of novel compounds with potential applications in the pharmaceutical and agrochemical industries.