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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-iodo-3-methyl-

Ic1c[nH]nc1C Request for Quotation
Chemical Name: 1H-Pyrazole, 4-iodo-3-methyl-
CAS Number: 15802-75-2
Product Number: AG001PWW(AGN-PC-0O4I9M)
Synonyms:
MDL No: MFCD09908176
Molecular Formula: C4H5IN2
Molecular Weight: 208.0004

Identification/Properties

Computed Properties
Molecular Weight:
208.002g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
207.95g/mol
Monoisotopic Mass:
207.95g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
66.7
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Iodo-3-methyl-1H-pyrazole is a versatile chemical compound widely used in chemical synthesis due to its unique properties and reactivity. This compound serves as a valuable building block in the preparation of various organic molecules, particularly in the pharmaceutical and agrochemical industries.In chemical synthesis, 4-Iodo-3-methyl-1H-pyrazole is frequently employed as a key intermediate for the synthesis of heterocyclic compounds. Its iodo substituent allows for further functionalization through cross-coupling reactions, such as Suzuki-Miyaura and Heck reactions, enabling the introduction of diverse functional groups. This versatility makes it a valuable tool for constructing complex molecular architectures with specific properties.Furthermore, 4-Iodo-3-methyl-1H-pyrazole can participate in substitution reactions, nucleophilic additions, and condensation reactions, providing a wide range of synthetic pathways for the formation of new chemical entities. Its structural features make it highly suitable for creating molecules with biological activity or advanced materials with tailored properties.Overall, the strategic utilization of 4-Iodo-3-methyl-1H-pyrazole in chemical synthesis enables chemists to access novel compounds and functionalized intermediates, paving the way for the development of innovative products in various industries.