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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)-

1-benzyl-4-iodopyrazole

Ic1cnn(c1)Cc1ccccc1 Request for Quotation
Chemical Name: 1-benzyl-4-iodopyrazole
CAS Number: 50877-42-4
Product Number: AG003E02(AGN-PC-0L060Y)
Synonyms:
MDL No:
Molecular Formula: C10H9IN2
Molecular Weight: 284.0963

Identification/Properties

Properties
MP:
63-66 °C
BP:
367.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
284.1g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
283.981g/mol
Monoisotopic Mass:
283.981g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
157
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The chemical compound 1-Benzyl-4-iodo-1H-pyrazole serves as a versatile building block in chemical synthesis processes. This unique compound offers a valuable functional group due to its reactive nature, specifically the iodine atom and pyrazole ring structure. In organic synthesis, 1-Benzyl-4-iodo-1H-pyrazole can be utilized as a key intermediate for the preparation of various complex molecules and organic compounds. The presence of the benzyl group provides a handle for further modifications through diverse chemical reactions, enabling the synthesis of structurally diverse compounds. Additionally, the iodo functionality on the pyrazole ring offers opportunities for cross-coupling reactions, halogenation, and other transformations, expanding the compound's applicability in creating novel chemical structures and functional materials. Its involvement in transition-metal-catalyzed reactions further enhances its utility in modern synthetic methodologies. Overall, the strategic incorporation of 1-Benzyl-4-iodo-1H-pyrazole in chemical synthesis enables the efficient construction of intricate molecules with tailored properties, making it a valuable asset in the toolkit of synthetic chemists.