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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, 1-methyl-2-nitro-3-(trifluoromethyl)-

[O-][N+](=O)c1c(C)cccc1C(F)(F)F Request for Quotation
Chemical Name: Benzene, 1-methyl-2-nitro-3-(trifluoromethyl)-
CAS Number: 92891-23-1
Product Number: AG00GVXO(AGN-PC-00MMQL)
Synonyms:
MDL No:
Molecular Formula: C8H6F3NO2
Molecular Weight: 205.1339

Identification/Properties

Properties
Storage:
2-8℃;
Computed Properties
Molecular Weight:
205.136g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
205.035g/mol
Monoisotopic Mass:
205.035g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
224
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-Methyl-2-nitro-3-(trifluoromethyl)benzene, also known as $name$, is a versatile compound widely utilized in chemical synthesis for its unique properties and reactivity. This compound serves as a valuable building block in organic chemistry, particularly in the production of advanced materials, pharmaceuticals, and agrochemicals. Its trifluoromethyl group provides enhanced stability and electron-withdrawing properties, making it an ideal precursor for the synthesis of complex molecules.In the realm of chemical synthesis, 1-Methyl-2-nitro-3-(trifluoromethyl)benzene plays a crucial role in the creation of fluorinated organic compounds, which are highly sought after for their diverse applications. The presence of the nitro group allows for precise functionalization, facilitating further derivatization and modification to tailor the properties of the final product. This compound's ability to participate in various organic reactions, such as nucleophilic substitutions and transition metal-catalyzed transformations, expands its utility in the synthesis of intricate molecular structures.With its strategic positioning of functional groups and fluorine substituents, 1-Methyl-2-nitro-3-(trifluoromethyl)benzene serves as a key intermediate in the development of novel compounds with enhanced properties, such as increased bioavailability, improved stability, and enhanced biological activity. Its versatility and compatibility with different synthetic methodologies make it a valuable asset in the toolkit of researchers and chemists working towards the advancement of modern chemistry and the creation of innovative materials and drugs.