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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 6-bromo-1,3-benzoxazole-2-carboxylate

COC(=O)c1nc2c(o1)cc(cc2)Br Request for Quotation
Chemical Name: methyl 6-bromo-1,3-benzoxazole-2-carboxylate
CAS Number: 954239-67-9
Product Number: AG0060AF(AGN-PC-09RRSA)
Synonyms:
MDL No:
Molecular Formula: C9H6BrNO3
Molecular Weight: 256.0528

Identification/Properties

Properties
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
256.055g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
254.953g/mol
Monoisotopic Mass:
254.953g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
236
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:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 6-bromobenzo[d]oxazole-2-carboxylate is a versatile compound commonly used in chemical synthesis as a key building block for various intermediate and final products. Due to its unique structure and reactivity, this compound is particularly valuable in organic chemistry applications.Primarily, Methyl 6-bromobenzo[d]oxazole-2-carboxylate is utilized in the synthesis of pharmaceuticals, agrochemicals, and advanced materials. Its bromo and carboxylate functional groups allow for selective manipulation, making it an essential starting material for the construction of complex molecules.In pharmaceutical synthesis, this compound is crucial for the development of novel drug candidates, as it enables the introduction of specific functional groups at precise positions on the molecular scaffold. Additionally, in agrochemical research, Methyl 6-bromobenzo[d]oxazole-2-carboxylate plays a vital role in creating potent pesticides and herbicides.Furthermore, this compound is instrumental in the production of specialty chemicals and advanced materials with diverse applications. Its versatility and compatibility with various synthetic methodologies make it a preferred choice for chemists working in the fields of medicinal chemistry, agrochemistry, and materials science.