Cas no 126832-84-6 (4-Piperidinone,3-acetyl-1-methyl-)
126832-84-6 structure
Product Name:4-Piperidinone,3-acetyl-1-methyl-
CAS No:126832-84-6
MF:C8H13NO2
MW:155.194322347641
CID:103326
PubChem ID:436780
Update Time:2025-04-18
4-Piperidinone,3-acetyl-1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Piperidinone,3-acetyl-1-methyl-
- 3-acetyl-1-methylpiperidin-4-one
- 4-Piperidinone, 3-acetyl-1-methyl- (9CI)
- SCHEMBL14593820
- 126832-84-6
- AKOS006332696
-
- Inchi： 1S/C8H13NO2/c1-6(10)7-5-9(2)4-3-8(7)11/h7H,3-5H2,1-2H3
- InChI Key： PFJXQSBSEALQMI-UHFFFAOYSA-N
- SMILES： O=C1CCN(C)CC1C(C)=O
Computed Properties
- Exact Mass: 155.09469
- Monoisotopic Mass: 155.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 37.4?2
Experimental Properties
- PSA: 37.38
4-Piperidinone,3-acetyl-1-methyl- Related Literature
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Jadwiga Frelek,Marcin Górecki,Marta ?aszcz,Agata Suszczyńska,Elemér Vass,Wojciech J. Szczepek Chem. Commun., 2012,48, 5295-5297
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
-
C. Achilli,G. F. Guidetti,A. Ciana,D. Capsoni,G. Minetti Biomater. Sci., 2016,4, 1417-1421
126832-84-6 (4-Piperidinone,3-acetyl-1-methyl-) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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