4H-1-Benzopyran-4-one, 2,3-dihydro-8-methoxy-


Chemical Name: 4H-1-Benzopyran-4-one, 2,3-dihydro-8-methoxy-
CAS Number: 20351-79-5
Product Number: AG0028YE(AGN-PC-0NI8P6)
Synonyms:
MDL No:
Molecular Formula: C10H10O3
Molecular Weight: 178.1846

Identification/Properties


Computed Properties
Molecular Weight:
178.187g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
178.063g/mol
Monoisotopic Mass:
178.063g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
202
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



8-Methoxychroman-4-one, also known as umbelliferone, is a versatile compound commonly used in chemical synthesis for its valuable properties. In organic chemistry, 8-Methoxychroman-4-one is utilized as a fluorescent probe due to its ability to emit blue fluorescence under UV light, making it ideal for labeling and tracking various molecules in biological systems. Additionally, this compound is frequently employed in the synthesis of coumarin derivatives, which have a wide range of applications in pharmaceuticals, agriculture, and material science. The unique structure of 8-Methoxychroman-4-one allows for facile modification, making it a valuable building block for creating new compounds with diverse functions. Its role in chemical synthesis extends to the development of novel drugs, agrochemicals, and materials with tailored properties, making it a highly sought-after ingredient in research and industry.