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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)-

Methyl 2-fluoro-3-nitrobenzoate

COC(=O)c1cccc(c1F)[N+](=O)[O-] Request for Quotation
Chemical Name: Methyl 2-fluoro-3-nitrobenzoate
CAS Number: 946126-94-9
Product Number: AG00H5S1(AGN-PC-00MP5H)
Synonyms:
MDL No:
Molecular Formula: C8H6FNO4
Molecular Weight: 199.1359

Identification/Properties

Properties
MP:
77- 80° C
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.137g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
199.028g/mol
Monoisotopic Mass:
199.028g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
240
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 2-fluoro-3-nitrobenzoate is a versatile chemical compound commonly used in chemical synthesis processes. This compound plays a crucial role in organic reactions, particularly in the pharmaceutical and agrochemical industries. Its unique properties make it an essential building block for the synthesis of various complex molecules.In chemical synthesis, Methyl 2-fluoro-3-nitrobenzoate can act as a key intermediate in the production of pharmaceutical drugs, agrochemicals, and other fine chemicals. Its fluoro and nitro functional groups allow for selective reactions, enabling chemists to introduce specific functionalities into target molecules with precision. This compound is often utilized in the preparation of biologically active compounds and serves as a valuable starting material for the creation of new chemical entities.Furthermore, Methyl 2-fluoro-3-nitrobenzoate exhibits excellent reactivity and compatibility with a wide range of reagents and reaction conditions. This versatility makes it a preferred choice for synthetic chemists seeking to unlock novel pathways in their research and development efforts. With its strategic placement of functional groups, this compound facilitates the synthesis of intricate molecular structures with enhanced pharmacological or pesticidal properties.Overall, Methyl 2-fluoro-3-nitrobenzoate is a powerful tool in the hands of chemists engaged in organic synthesis. Its importance lies in its ability to enable the efficient construction of complex molecules for various industrial applications, contributing to advancements in the fields of medicine, agriculture, and materials science.