1H-Indole-3-acetic acid, 6-(phenylmethoxy)-


Chemical Name: 1H-Indole-3-acetic acid, 6-(phenylmethoxy)-
CAS Number: 682802-82-0
Product Number: AG00IBT6(AGN-PC-03ZMRD)
Synonyms:
MDL No:
Molecular Formula: C17H15NO3
Molecular Weight: 281.3059

Identification/Properties


Computed Properties
Molecular Weight:
281.311g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
281.105g/mol
Monoisotopic Mass:
281.105g/mol
Topological Polar Surface Area:
62.3A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
354
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid, also known as $name$, is a versatile compound widely used in chemical synthesis due to its unique structural properties and reactivity. As a substituted indole derivative, this compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and functional materials.One key application of 2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid in chemical synthesis is its role as a precursor in the preparation of indole-based drug molecules. Indole derivatives have demonstrated diverse biological activities, including anticancer, antimicrobial, and anti-inflammatory properties. By incorporating 2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid into the synthesis of indole-containing drugs, researchers can modulate the compound's pharmacological profile and enhance its therapeutic potential.Furthermore, 2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid can be utilized in the synthesis of novel organic compounds with tunable physical and chemical properties. Its indole moiety offers a platform for introducing functional groups that dictate the compound's reactivity, solubility, and stability. By strategically modifying the structure of 2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid, chemists can access a wide range of derivatives with tailored properties for specific applications in materials science and chemical biology.Overall, the versatile nature of 2-(6-(Benzyloxy)-1H-indol-3-yl)acetic acid makes it a valuable tool in chemical synthesis, enabling the creation of complex molecules with therapeutic, agricultural, and material-related functionalities.