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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)-

Benzeneacetic acid, 3-amino-2,6-difluoro-, methyl ester

COC(=O)Cc1c(F)ccc(c1F)N Request for Quotation
Chemical Name: Benzeneacetic acid, 3-amino-2,6-difluoro-, methyl ester
CAS Number: 361336-80-3
Product Number: AG007BDF(AGN-PC-0NDMCL)
Synonyms:
MDL No:
Molecular Formula: C9H9F2NO2
Molecular Weight: 201.1701

Identification/Properties

Computed Properties
Molecular Weight:
201.173g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
201.06g/mol
Monoisotopic Mass:
201.06g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
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


The Benzeneacetic acid, 3-amino-2,6-difluoro-, methyl ester is a versatile compound commonly used in chemical synthesis due to its unique properties and reactivity. This compound serves as a valuable building block in the creation of pharmaceuticals, agrochemicals, and fine chemicals. Its amino and difluoro functional groups offer a wide range of modification possibilities, making it a key intermediate in the synthesis of various complex molecules. Additionally, the methyl ester moiety provides stability and facilitates the compound's incorporation into different synthetic pathways. Researchers and chemists commonly utilize this compound to introduce specific functionalities into target molecules, allowing for precise control over the structure and properties of the final products.