Cas no 51206-36-1 (5-Ethylpiperidin-2-one)
5-Ethylpiperidin-2-one structure
Product Name:5-Ethylpiperidin-2-one
CAS No:51206-36-1
MF:C7H13NO
MW:127.184221982956
CID:2829664
PubChem ID:18428602
Update Time:2025-04-21
5-Ethylpiperidin-2-one Chemical and Physical Properties
Names and Identifiers
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- DTXSID10593690
- 51206-36-1
- SCHEMBL7030866
- 2-Piperidinone, 5-ethyl-
- AKOS006353905
- DB-095277
- 5-Ethylpiperidin-2-one
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- Inchi： 1S/C7H13NO/c1-2-6-3-4-7(9)8-5-6/h6H,2-5H2,1H3,(H,8,9)
- InChI Key： BPIZRWVWYUPAQQ-UHFFFAOYSA-N
- SMILES： O=C1CCC(CC)CN1
Computed Properties
- Exact Mass: 127.099714038Da
- Monoisotopic Mass: 127.099714038Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 111
- 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: 0.8
- Topological Polar Surface Area: 29.1?2
5-Ethylpiperidin-2-one Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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