Cas no 36646-78-3 (5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one)
5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one is a cyclohexenone derivative featuring a substituted aromatic amine group. This compound is of interest in synthetic organic chemistry due to its structural motif, which may serve as a key intermediate in the preparation of more complex molecules. The presence of both electron-donating and sterically hindered groups influences its reactivity, making it suitable for selective transformations. Its stable cyclohexenone core allows for further functionalization, while the dimethyl substitution enhances steric control in subsequent reactions. This compound may find applications in pharmaceuticals, agrochemicals, or materials science, where tailored molecular architectures are required.
36646-78-3 structure
Product Name:5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one
CAS No:36646-78-3
MF:C15H19NO
MW:229.317464113235
CID:1477879
PubChem ID:744716
Update Time:2025-05-28
5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one Chemical and Physical Properties
Names and Identifiers
-
- 2-Cyclohexen-1-one, 5,5-dimethyl-3-[(4-methylphenyl)amino]-
- 5,5-dimethyl-3-(4-methylanilino)cyclohex-2-en-1-one
- 5,5-Dimethyl-3-(p-tolylamino)cyclohex-2-enone
- STK541888
- Z57082356
- 5,5-dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one
- AKOS005471610
- AKOS001152121
- ALBB-013647
- SR-01000479705-1
- 5,5-Dimethyl-3-[(4-methylphenyl)amino]-cyclohex-2-en-1-one
- DTXSID60353544
- (3E)-5,5-dimethyl-3-[(4-methylphenyl)imino]cyclohex-1-en-1-ol
- 3-(p-tolylamino)-5,5-dimethylcyclohex-2-enone
- 2-cyclohexen-1-one, 5,5-dimethyl-3-[(4-methylphenyl)amino]
- MFCD00128470
- 36646-78-3
- STK006224
- LS-04275
- 5,5-Dimethyl-3-(p-tolylamino)cyclohex-2-en-1-one
- CS-0281378
- SR-01000479705
- 5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one
-
- Inchi: 1S/C15H19NO/c1-11-4-6-12(7-5-11)16-13-8-14(17)10-15(2,3)9-13/h4-8,16H,9-10H2,1-3H3
- InChI Key: AUTYGHSAKXEUSV-UHFFFAOYSA-N
- SMILES: O=C1C=C(CC(C)(C)C1)NC1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 229.14677
- Monoisotopic Mass: 229.146664230g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 322
- 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: 3.4
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | D265590-100mg |
5,5-Dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one |
36646-78-3 | 100mg |
$ 185.00 | 2022-06-05 | ||
| TRC | D265590-250mg |
5,5-Dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one |
36646-78-3 | 250mg |
$ 380.00 | 2022-06-05 | ||
| TRC | D265590-500mg |
5,5-Dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one |
36646-78-3 | 500mg |
$ 600.00 | 2022-06-05 | ||
| Crysdot LLC | CD12078273-1g |
5,5-Dimethyl-3-(p-tolylamino)cyclohex-2-enone |
36646-78-3 | 97% | 1g |
$320 | 2024-07-24 | |
| Crysdot LLC | CD12078273-5g |
5,5-Dimethyl-3-(p-tolylamino)cyclohex-2-enone |
36646-78-3 | 97% | 5g |
$904 | 2024-07-24 | |
| A2B Chem LLC | AJ02999-500mg |
5,5-Dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one |
36646-78-3 | >95% | 500mg |
$523.00 | 2024-04-20 | |
| A2B Chem LLC | AJ02999-1g |
5,5-Dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one |
36646-78-3 | >95% | 1g |
$578.00 | 2024-04-20 |
5,5-Dimethyl-3-(4-methylphenyl)aminocyclohex-2-en-1-one Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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