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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, 4-amino-2,6-difluoro-, methyl ester

COC(=O)c1c(F)cc(cc1F)N Request for Quotation
Chemical Name: Benzoic acid, 4-amino-2,6-difluoro-, methyl ester
CAS Number: 191478-99-6
Product Number: AG002F9E(AGN-PC-03X6JP)
Synonyms:
MDL No:
Molecular Formula: C8H7F2NO2
Molecular Weight: 187.1435

Identification/Properties

Properties
BP:
306°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
187.146g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
187.044g/mol
Monoisotopic Mass:
187.044g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
189
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:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

PNMR/METHYL4-AMINO-26-DIFLUOROBENZOATE-191478-99-6-hnmr.pdf

Other Analytical Data

POTHER/METHYL4-AMINO-26-DIFLUOROBENZOATE-191478-99-6-gc.pdf

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Chemical Structure


Methyl 4-amino-2,6-difluorobenzoate is a versatile compound widely used in chemical synthesis. It serves as a key building block in the production of pharmaceuticals, agrochemicals, and various specialty chemicals. Due to its unique properties, this compound plays a crucial role in the development of innovative materials and advanced chemical processes. In chemical synthesis, Methyl 4-amino-2,6-difluorobenzoate acts as a valuable intermediate that enables the efficient construction of complex molecular structures. Its compatibility with a wide range of reaction conditions makes it a valuable tool for organic synthesis, providing chemists with the flexibility to explore new synthetic pathways and optimize existing methodologies. This compound's diverse applications highlight its importance in the field of chemical research and development, contributing to the advancement of various industries.