Benzaldehyde, 4-ethoxy-3-methoxy-


Chemical Name: Benzaldehyde, 4-ethoxy-3-methoxy-
CAS Number: 120-25-2
Product Number: AG000Q01(AGN-PC-0JL7M0)
Synonyms:
MDL No:
Molecular Formula: C10H12O3
Molecular Weight: 180.2005

Identification/Properties


Properties
MP:
50-53 °C(lit.)
BP:
289.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Refractive Index:
1.5224 (estimate)
Computed Properties
Molecular Weight:
180.203g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
180.079g/mol
Monoisotopic Mass:
180.079g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
158
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



Benzaldehyde, 4-ethoxy-3-methoxy-, is a versatile chemical compound widely used in chemical synthesis. This compound is commonly employed as a key building block in the creation of various organic molecules due to its unique properties and reactivity. In chemical synthesis, Benzaldehyde, 4-ethoxy-3-methoxy-, serves as a valuable starting material for the production of pharmaceuticals, agrochemicals, fragrances, and fine chemicals. Its ability to undergo different types of reactions, such as condensation, oxidation, and reduction, makes it an essential component in the construction of complex organic structures. Additionally, its distinct ethoxy and methoxy functional groups offer opportunities for selective modifications and derivatizations, allowing chemists to tailor its structure for specific applications. This compound plays a crucial role in the synthesis of various compounds with biological activities or functional properties, making it a key player in the field of organic chemistry.