Acetic acid, [[1-(phenylmethyl)-1H-indazol-3-yl]oxy]-


Chemical Name: Acetic acid, [[1-(phenylmethyl)-1H-indazol-3-yl]oxy]-
CAS Number: 20187-55-7
Product Number: AG0027WQ(AGN-PC-0JK66Z)
Synonyms:
MDL No: MFCD00866158
Molecular Formula: C16H14N2O3
Molecular Weight: 282.2940

Identification/Properties


Properties
MP:
161-163 °C
BP:
508.2°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.6240 (estimate)
Computed Properties
Molecular Weight:
282.299g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
282.1g/mol
Monoisotopic Mass:
282.1g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
357
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


NMR Spectrum


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Chemical Structure



Acetic acid, 2-[[1-(phenylmethyl)-1H-indazol-3-yl]oxy]- is a versatile compound widely utilized in chemical synthesis processes. This compound serves as a key building block in the creation of various organic molecules and pharmaceutical products. Its unique structure and reactivity allow it to participate in a range of reactions, including esterification, acylation, and coupling reactions. By incorporating Acetic acid, 2-[[1-(phenylmethyl)-1H-indazol-3-yl]oxy]- into synthesis pathways, chemists can efficiently access complex molecular structures with diverse applications in drug discovery, material science, and fine chemical manufacturing.