Phenol, 4-butoxy-


Chemical Name: Phenol, 4-butoxy-
CAS Number: 122-94-1
Product Number: AG0016JQ(AGN-PC-0JKLTG)
Synonyms:
MDL No:
Molecular Formula: C10H14O2
Molecular Weight: 166.2170

Identification/Properties


Computed Properties
Molecular Weight:
166.22g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
166.099g/mol
Monoisotopic Mass:
166.099g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
106
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Phenol, 4-butoxy- is a versatile compound commonly used in chemical synthesis for its ability to participate in a wide range of reactions. This particular derivative of phenol is valued for its unique properties that make it a valuable building block in the creation of various organic compounds. In organic synthesis, Phenol, 4-butoxy- can be utilized as a starting material for the production of pharmaceuticals, agrochemicals, and fine chemicals. Its structure allows for selective modifications, enabling chemists to generate novel molecules with specific functionalities. Additionally, Phenol, 4-butoxy- can serve as a key intermediate in the synthesis of natural products and complex organic molecules, contributing to advancements in the field of medicinal chemistry and material science. Its compatibility with different reaction conditions and reagents makes it a crucial component in the toolbox of synthetic chemists aiming to design and create innovative compounds for various applications in the industry.