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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)-

2-Cyclohexen-1-one, 2-iodo-

O=C1CCCC=C1I Request for Quotation
Chemical Name: 2-Cyclohexen-1-one, 2-iodo-
CAS Number: 33948-36-6
Product Number: AG00C8Q6(AGN-PC-0NFZVL)
Synonyms:
MDL No:
Molecular Formula: C6H7IO
Molecular Weight: 222.0237

Identification/Properties

Computed Properties
Molecular Weight:
222.02g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
221.95416g/mol
Monoisotopic Mass:
221.95416g/mol
Topological Polar Surface Area:
17.1Ų
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
138
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Iodo-2-cyclohexen-1-one is a versatile compound widely utilized in chemical synthesis for its unique reactivity and structural features. In organic chemistry, it serves as a valuable building block for the introduction of functional groups and structural motifs in complex molecule assembly. Its presence of both an iodine and a carbonyl group makes it a convenient starting material for various chemical transformations and reactions.One key application of 2-Iodo-2-cyclohexen-1-one in chemical synthesis is its use as a versatile electrophile in various coupling reactions. Through nucleophilic substitution reactions, the iodo group can be easily replaced by different nucleophiles, such as amines, thiols, or organometallic reagents, leading to the synthesis of diverse functionalized products. This compound can also undergo conjugate addition reactions to introduce carbon-carbon bonds at the conjugated carbonyl system, enabling the construction of complex molecular frameworks.Moreover, 2-Iodo-2-cyclohexen-1-one can participate in palladium-catalyzed cross-coupling reactions, such as Suzuki-Miyaura or Heck coupling, to form biaryl or vinyl heteroaryl compounds, respectively. These transformations allow for the rapid construction of biologically active molecules, natural product analogs, or materials with specific properties.Overall, the versatile reactivity of 2-Iodo-2-cyclohexen-1-one in various chemical transformations makes it a valuable tool in organic synthesis, enabling the efficient and selective construction of complex molecules and functionalized intermediates.