Cas no 18940-21-1 (3-Anilino-5,5-dimethyl-2-cyclohexen-1-one)

3-Anilino-5,5-dimethyl-2-cyclohexen-1-one is a versatile cyclic enone derivative with applications in organic synthesis and pharmaceutical research. Its structure features a conjugated enone system with an anilino substituent, enhancing its reactivity in Michael additions and other nucleophilic reactions. The 5,5-dimethyl substitution provides steric stability, improving selectivity in synthetic pathways. This compound serves as a valuable intermediate in the preparation of heterocyclic compounds and fine chemicals. Its well-defined molecular framework allows for predictable reactivity, making it useful in the development of bioactive molecules and specialty materials. The product is typically supplied in high purity, ensuring consistent performance in research and industrial applications.
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one structure
18940-21-1 structure
Product Name:3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
CAS No:18940-21-1
MF:C14H17NO
MW:215.290883779526
MDL:MFCD00128479
CID:1384278
PubChem ID:205896
Update Time:2025-05-28

3-Anilino-5,5-dimethyl-2-cyclohexen-1-one Chemical and Physical Properties

Names and Identifiers

    • 5,5-dimethyl-3-(phenylamino)cyclohex-2-en-1-one
    • 2-Cyclohexen-1-one, 5,5-dimethyl-3-(phenylamino)-
    • 3-Anilino-5,5-dimethylcyclohex-2-en-1-one
    • 3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
    • BRD-K99717719-001-01-6
    • SR-01000479702
    • CS-0318362
    • SR-01000479702-1
    • 5,5-Dimethyl-3-(phenylamino)-2-cyclohexen-1-one
    • MFCD00128479
    • STL360586
    • 3-12-00-00341 (Beilstein Handbook Reference)
    • CHEMBL301033
    • CCG-110519
    • MS-6301
    • HMS2800N07
    • AKOS001651996
    • MLS000779838
    • SMR000420030
    • CHEMBL3213882
    • 5,5-dimethyl-3-anilinocyclohex-2-en-1-one
    • BRN 2097764
    • HMS1480H12
    • DTXSID40172351
    • 5,5-dimethyl-3-phenylamino-2-cyclohexen-1-one
    • 3-Anilino-5,5-dimethyl-2-cyclohexenone
    • 5,5-dimethyl-3-(phenylamino)cyclohex-2-enone
    • 18940-21-1
    • SCHEMBL486053
    • 5,5-Dimethyl-3-phenylamino-cyclohex-2-enone
    • NCGC00246420-01
    • ChemDiv3_002630
    • 3-Anilino-5,5-dimethylcyclohex-2-enone
    • 3-Phenylamino-5,5-dimethyl-2-cyclohexen-1-one
    • LIHRRTOWVCDHLR-UHFFFAOYSA-N
    • MDL： MFCD00128479
    • Inchi： 1S/C14H17NO/c1-14(2)9-12(8-13(16)10-14)15-11-6-4-3-5-7-11/h3-8,15H,9-10H2,1-2H3
    • InChI Key： LIHRRTOWVCDHLR-UHFFFAOYSA-N
    • SMILES： O=C1C=C(CC(C)(C)C1)NC1C=CC=CC=1

Computed Properties

  • Exact Mass: 215.13111
  • Monoisotopic Mass: 215.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 298
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • Color/Form: NA
  • Density: 1.089
  • Boiling Point: 331.6°C at 760 mmHg
  • Flash Point: 123.9°C
  • Refractive Index: 1.582
  • PSA: 29.1

3-Anilino-5,5-dimethyl-2-cyclohexen-1-one Security Information

3-Anilino-5,5-dimethyl-2-cyclohexen-1-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
A672505-10mg
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
 18940-21-1
10mg
 $ 50.00 2022-06-07
TRC
A672505-50mg
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
 18940-21-1
50mg
 $ 65.00 2022-06-07
TRC
A672505-100mg
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
 18940-21-1
100mg
 $ 80.00 2022-06-07
Apollo Scientific
OR311067-1g
3-Anilino-5,5-dimethyl-2-cyclohexen-1-one
 18940-21-1
1g
 ￡95.00 2025-02-19
abcr
AB160219-1 g
5,5-Dimethyl-3-(phenylamino)cyclohex-2-en-1-one
 18940-21-1
1 g
 €132.50 2023-07-20
abcr
AB160219-2 g
5,5-Dimethyl-3-(phenylamino)cyclohex-2-en-1-one
 18940-21-1
2 g
 €167.50 2023-07-20
abcr
AB160219-5 g
5,5-Dimethyl-3-(phenylamino)cyclohex-2-en-1-one
 18940-21-1
5 g
 €290.00 2023-07-20
abcr
AB160219-10 g
5,5-Dimethyl-3-(phenylamino)cyclohex-2-en-1-one
 18940-21-1
10 g
 €325.00 2023-07-20
1PlusChem
1P002E4D-250mg
2-Cyclohexen-1-one, 5,5-dimethyl-3-(phenylamino)-
 18940-21-1 98%
250mg
 $50.00 2025-02-19
eNovation Chemicals LLC
Y1256624-250mg
2-Cyclohexen-1-one, 5,5-dimethyl-3-(phenylamino)-
 18940-21-1 98%
250mg
 $175 2025-02-19

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