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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

3-(3-oxomorpholin-4-yl)benzoic acid

O=C1COCCN1c1cccc(c1)C(=O)O Request for Quotation
Chemical Name: 3-(3-oxomorpholin-4-yl)benzoic acid
CAS Number: 1194374-14-5
Product Number: AG000IRJ(AGN-PC-0JF47H)
Synonyms:
MDL No:
Molecular Formula: C11H11NO4
Molecular Weight: 221.2093

Identification/Properties

Computed Properties
Molecular Weight:
221.212g/mol
XLogP3:
0.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
221.069g/mol
Monoisotopic Mass:
221.069g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
292
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-(3-Oxomorpholino)benzoic acid, also known as $name$, serves as a versatile building block in chemical synthesis due to its unique molecular structure and reactivity. In chemical synthesis, 3-(3-Oxomorpholino)benzoic acid can be utilized as a key intermediate in the production of pharmaceutical compounds, agrochemicals, and specialty chemicals. This compound can undergo various chemical transformations, such as acylation, amidation, and esterification reactions, to introduce specific functional groups into the final product. Additionally, the presence of the morpholino ring in 3-(3-Oxomorpholino)benzoic acid imparts distinctive properties to the molecule, making it valuable for the synthesis of bioactive molecules and drug candidates. The morpholino group can participate in hydrogen bonding interactions and enhance the compound's solubility and bioavailability.Overall, 3-(3-Oxomorpholino)benzoic acid plays a crucial role in the field of chemical synthesis by enabling the efficient and controlled construction of complex molecules with diverse applications in the pharmaceutical and agrochemical industries.