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5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one is a complex organic compound characterized by a cyclohexenone ring structure. It features two methyl groups at the 5-position, a phenyl group attached to a vinyl group at the 3-position, and an E-configuration indicating the trans arrangement of the phenyl and vinyl groups. 5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one is known for its potential applications in the synthesis of various pharmaceuticals and agrochemicals due to its unique structural properties. It is also recognized for its role in the formation of certain natural products and as an intermediate in organic synthesis. The compound's specific structure and reactivity make it a valuable component in the development of new chemical entities with diverse applications.

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  • 6502-98-3 Structure
  • Basic information

    1. Product Name: 5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one
    2. Synonyms:
    3. CAS NO:6502-98-3
    4. Molecular Formula:
    5. Molecular Weight: 226.318
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 6502-98-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one(6502-98-3)
    11. EPA Substance Registry System: 5,5-dimethyl-3-[(E)-2-phenylvinyl]cyclohex-2-en-1-one(6502-98-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 6502-98-3(Hazardous Substances Data)

6502-98-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6502-98-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,5,0 and 2 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 6502-98:
(6*6)+(5*5)+(4*0)+(3*2)+(2*9)+(1*8)=93
93 % 10 = 3
So 6502-98-3 is a valid CAS Registry Number.

6502-98-3Relevant articles and documents

Handy Protocols using Vinyl Nosylates in Suzuki-Miyaura Cross-Coupling Reactions

Dikova, Anna,Cheval, Nicolas P.,Blanc, Aurélien,Weibel, Jean-Marc,Pale, Patrick

, p. 4093 - 4100 (2015)

Vinyl nosylates derived from 1,3-dicarbonyl compounds could be engaged in Suzuki-Myaura cross coupling reactions with aryl-, vinyl- and methylboronic acids or trifluoborate derivatives at room temperature in the presence of 2mol% of [1,1′-bis(diphenylphosphino)ferrocene]dichloropalladium(II) [PdCl2(dppf)]. One-pot procedures have been set up for practical and efficient nosylation-cross-coupling reactions. Nosylate, as a cheap novel pseudo-halide, gives very stable compounds and is very efficient in Suzuki-Myaura cross coupling reactions (21 examples, 44-99%).

Tandem aldol condensation-Diels-Alder-aromatization sequence of reactions: A new pathway for the synthesis of 2-tetralone derivatives

Abaee, M. Saeed,Doustkhah, Esmail,Mohammadi, Mohaddeseh,Mojtahedi, Mohammad M.,Harms, Klaus

, p. 733 - 737 (2016/11/13)

A series of new polysubstituted derivatives of 2-tetralones possessing two ester groups were synthesized via a tandem aldol condensation-Diels-Alder-aromatization sequence of reactions. All the three steps took place in one pot and in the presence of amin

Vinyl nosylates: An ideal partner for palladium-catalyzed cross-coupling reactions

Cheval, Nicolas P.,Dikova, Anna,Blanc, Aurelien,Weibel, Jean-Marc,Pale, Patrick

, p. 8765 - 8768 (2013/07/26)

In a hurry to leave! Nosylates act as an excellent leaving group in various palladium-catalyzed cross-couplings, such as Suzuki, Stille, Heck, and Sonogashira reactions (see scheme). Crystalline, stable, and cheap vinyl and aryl nosylates proved better th

Suzuki-Miyaura cross-coupling of alkenyl tosylates with alkenyl MIDA boronates

Lüthy, Monique,Taylor, Richard J.K.

, p. 3444 - 3447 (2012/08/08)

A practical procedure for the palladium-catalysed Suzuki-Miyaura coupling of various alkenyl tosylates with alkenyl MIDA boronates has been developed. Commercially available trans-bromo[N-succinimidyl-bis(triphenylphosphine)] palladium(II) [Pd(PPh3/

A novel and efficient tandem aldol condensation-Diels-Alder reaction pathway for the direct synthesis of dehydrodecaline derivatives

Abaee, M. Saeed,Mojtahedi, Mohammad M.,Saberi, Farveh,Karimi, Ghazal,Rezaei, M. Taghi,Mesbah, A. Wahid,Harms, Klaus,Massa, Werner

, p. 2073 - 2076 (2012/10/30)

An efficient direct synthesis of dehydrodecaline derivatives is reported via a tandem aldol condensation-Diels-Alder cycloaddition process under Lewis acidic conditions. Addition of dienophile moieties to conjugated dienes, formed in situ from the condens

Facile solvent-free synthesis and structural elucidation of styrylcyclohex-2-enone derivatives

Mojtahedi, Mohammad M.,Abaee, Mohammad Saeed,Zahedi, Mohammad Mehdi,Jalali, Mohammad R.,Mesbah, A. Wahid,Massa, Werner,Yaghoubi, Roholah,Forouzani, Mehdi

experimental part, p. 917 - 921 (2009/09/06)

A remarkably efficient procedure for the synthesis of styrylcyclohex-2- enone derivatives at room temperature is described using a mild reaction medium consisting of lithium perchlorate and N-(trimethylsilyl)diethylamine. Several compounds of this class a

Synthesis of 1,2-diazaphenalenes under microwave

El Barkaoui, Yousri,Jorio, Noura,Fkih-Tétouani, Souad,El Louzi, Ahmed,Loupy, André

, p. 1517 - 1525 (2007/10/03)

1,2-Diazaphenalenes were prepared by condensation reactions of hydrazine with isophorone derivatives under various conditions: conventional heating in homogeneous solution and microwave activation either in homogeneous solution or in dry media. Microwave

Carbonyl transposition on organoselenium compounds

Comasseto, Joao V.,Lo, Wai L.,Petragnani, Nicola

, p. 7445 - 7460 (2007/10/03)

Carbonyl conjugated vinylic selenides undergo 1,3 and 1,5-carbonyl transposition sequences through organometallic reagents addition reactions followed by acid hydrolysis.

Condensation reactions in water of active methylene compounds with arylaldehydes. One-pot synthesis of flavonols

Fringuelli, Francesco,Pani, Giosanna,Piermatti, Oriana,Pizzo, Ferdinando

, p. 11499 - 11508 (2007/10/02)

The condensation reactions of acetophenone, cyclohexanone, isophorone, phenylacetonitrile, p-nitrophenylacetonitrile, (phenylsulfonyl)acetonitrile and indene with benzaldehyde were studied in water heterogeneous phase in the presence and absence of anionic and cationic surfactants such as SLS, CTACl, (CTA)2SO4 and CTAOH. All the reactions occur with excellent yields. The cationic surfactants favour the reaction and the comparison with the corresponding tetrabutylammonium salts show that the micellar catalysis is effective mainly towards the dehydration reaction following that of condensation. Anionic surfactant SLS is inactive. 2'-hydroxychalcones were prepared in aqueous medium in good-excellent yields and the one-pot synthesis of 7- and 3',4'-substituted flavonols was achieved.

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