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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)-

Benzoic acid, 2-(acetylamino)-3-nitro-, methyl ester

COC(=O)c1cccc(c1NC(=O)C)[N+](=O)[O-] Request for Quotation
Chemical Name: Benzoic acid, 2-(acetylamino)-3-nitro-, methyl ester
CAS Number: 95067-27-9
Product Number: AG0066IL(AGN-PC-0KL1JY)
Synonyms:
MDL No:
Molecular Formula: C10H10N2O5
Molecular Weight: 238.1968

Identification/Properties

Properties
MP:
121-122 °C
BP:
451.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
238.199g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
238.059g/mol
Monoisotopic Mass:
238.059g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
325
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:
H315-H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 2-acetamido-3-nitrobenzoate, also known as $name$, plays a crucial role in chemical synthesis as a versatile building block. This compound is commonly utilized in organic reactions to introduce both acetamido and nitro functional groups into target molecules. With its strategic placement of these reactive groups, $name$ enables chemists to generate a wide range of complex organic compounds with tailored properties.In chemical synthesis, the acetamido group in $name$ serves as a versatile functionality, participating in various reactions such as amidation, acylation, and hydrogen bonding. This group can be further modified to introduce diverse chemical functionalities, expanding the scope of synthetic possibilities. The nitro group, on the other hand, offers a unique reactivity that can be leveraged for further functionalization through reduction or transformation into other useful groups.The application of Methyl 2-acetamido-3-nitrobenzoate in chemical synthesis extends beyond just the introduction of specific functional groups. Its strategic incorporation into synthetic pathways allows for the construction of complex molecular architectures with precision and control. By serving as a key intermediate in multistep synthesis, $name$ enables chemists to access structurally diverse compounds that are essential in drug discovery, material science, and other fields of organic chemistry.