Benzoic acid, 4-methoxy-3-propoxy-


Chemical Name: Benzoic acid, 4-methoxy-3-propoxy-
CAS Number: 5922-57-6
Product Number: AG00EDVI(AGN-PC-0KK825)
Synonyms:
MDL No:
Molecular Formula: C11H14O4
Molecular Weight: 210.2265

Identification/Properties


Computed Properties
Molecular Weight:
210.229g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
210.089g/mol
Monoisotopic Mass:
210.089g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
205
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



4-METHOXY-3-PROPOXYBENZOIC ACID, also known as MPOBA, is a versatile compound widely used in chemical synthesis due to its unique properties. In organic synthesis, this compound serves as a key building block for the creation of various organic molecules and pharmaceutical intermediates. One of the main applications of 4-METHOXY-3-PROPOXYBENZOIC ACID is as a precursor in the synthesis of esters and ethers. Its methoxy and propoxy functional groups can be selectively modified to introduce specific chemical functionalities, allowing for the generation of a diverse range of compounds with different properties and applications. Additionally, 4-METHOXY-3-PROPOXYBENZOIC ACID can be utilized in the preparation of liquid crystal materials, which are crucial components in the production of displays for electronic devices. Its compatibility with other chemical reagents and its ability to undergo various chemical transformations make it a valuable tool in the field of chemical synthesis.