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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)-

1H-Pyrazole, 4-bromo-1-ethenyl-

Brc1cn(nc1)C=C Request for Quotation
Chemical Name: 1H-Pyrazole, 4-bromo-1-ethenyl-
CAS Number: 80308-80-1
Product Number: AG005N2K(AGN-PC-00MT32)
Synonyms:
MDL No:
Molecular Formula: C5H5BrN2
Molecular Weight: 173.0106

Identification/Properties

Computed Properties
Molecular Weight:
173.013g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
171.964g/mol
Monoisotopic Mass:
171.964g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
94.4
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#:
2810
Hazard Statements:
H301-H311-H331
Precautionary Statements:
P261-P264-P270-P271-P280-P302+P352-P304+P340-P310-P330-P361-P403+P233-P405-P501
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Bromo-1-vinyl-1H-pyrazole is a versatile chemical compound widely used in chemical synthesis for its unique properties. In organic synthesis, this compound serves as a valuable building block for the preparation of various functionalized pyrazole derivatives. Its vinyl group allows for further modification through cross-coupling reactions, making it an important intermediate in the synthesis of pharmaceuticals, agrochemicals, and materials. Additionally, the presence of the bromo moiety enables selective functionalization reactions, making it a useful tool for the construction of complex molecular structures. Overall, 4-Bromo-1-vinyl-1H-pyrazole plays a crucial role in the development of novel compounds with diverse applications in the field of organic chemistry.