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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)-

Benzene, 2-(bromomethyl)-1-fluoro-3-nitro-

BrCc1c(F)cccc1[N+](=O)[O-] Request for Quotation
Chemical Name: Benzene, 2-(bromomethyl)-1-fluoro-3-nitro-
CAS Number: 1958-93-6
Product Number: AG003HB8(AGN-PC-0JLBUD)
Synonyms:
MDL No:
Molecular Formula: C7H5BrFNO2
Molecular Weight: 234.0225

Identification/Properties

Properties
BP:
275.5°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
234.024g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
232.949g/mol
Monoisotopic Mass:
232.949g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
173
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:
Danger
UN#:
3261
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P305+P351+P338-P309-P310
Class:
8
Packing Group:
Ⅱ

NMR Spectrum

Other Analytical Data

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Chemical Structure


The compound Benzene, 2-(bromomethyl)-1-fluoro-3-nitro- is a versatile molecule that finds significant application in chemical synthesis. It serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and advanced materials. This compound plays a crucial role in the synthesis of complex organic molecules by acting as a halogenated intermediate. The bromomethyl group is a reactive site that can undergo further modification to introduce various functional groups onto the benzene ring. The fluorine and nitro groups also provide opportunities for diverse chemical reactions, allowing for the synthesis of a wide range of compounds with tailored properties.In organic synthesis, Benzene, 2-(bromomethyl)-1-fluoro-3-nitro- serves as a valuable tool for the incorporation of specific chemical moieties into target molecules. Its strategic placement within a molecular structure can facilitate the creation of new compounds with enhanced biological activity or material properties.