Cas no 61682-93-7 (4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl-)
61682-93-7 structure
Product Name:4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl-
CAS No:61682-93-7
MF:C12H23NO
MW:197.317123651505
CID:470230
PubChem ID:22182213
Update Time:2025-04-19
4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl-
- 2,6-diethyl-2,3,6-trimethylpiperidin-4-one
- SCHEMBL265547
- 2,6-diethyl-2,3,6-trimethyl-4-oxopiperidine
- TUOLXKNMFCOMGN-UHFFFAOYSA-N
- 2,6-diethyl-2,3,6-trimethyl piperidin-4-one
- 61682-93-7
- DTXSID20623331
- 2,6-diethyl-2,3,6-trimethyl-4-piperidone
- 2,6-diethyl-2,3,6-trimethylpiperidine-4-one
-
- Inchi： 1S/C12H23NO/c1-6-11(4)8-10(14)9(3)12(5,7-2)13-11/h9,13H,6-8H2,1-5H3
- InChI Key： TUOLXKNMFCOMGN-UHFFFAOYSA-N
- SMILES： O=C1CC(C)(CC)NC(C)(CC)C1C
Computed Properties
- Exact Mass: 197.17809
- Monoisotopic Mass: 197.177964357g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 3
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl- Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Jason Wan Lab Chip, 2020,20, 4528-4538
61682-93-7 (4-Piperidinone, 2,6-diethyl-2,3,6-trimethyl-) Related Products
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