1H-Pyrrole-1-acetic acid, methyl ester


Chemical Name: 1H-Pyrrole-1-acetic acid, methyl ester
CAS Number: 50966-72-8
Product Number: AG006V1O(AGN-PC-004KWV)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2
Molecular Weight: 139.1519

Identification/Properties


Computed Properties
Molecular Weight:
139.154g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
139.063g/mol
Monoisotopic Mass:
139.063g/mol
Topological Polar Surface Area:
31.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
119
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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Chemical Structure



Methyl 2-(1H-pyrrol-1-yl)acetate serves as a versatile building block in chemical synthesis, offering a range of applications across various industries. This compound plays a crucial role in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and other fine chemicals. Its unique structure and reactivity make it a valuable intermediate in the creation of complex molecules and bioactive compounds. When utilized in chemical reactions, Methyl 2-(1H-pyrrol-1-yl)acetate can facilitate the formation of new carbon-carbon and carbon-nitrogen bonds, enabling the synthesis of diverse functionalized compounds. Additionally, its presence in the molecular structure can impart desirable properties to the final products, enhancing their biological or chemical activities. This compound's significance in chemical synthesis underscores its importance as a key component in the development of novel compounds with targeted applications.