Cas no 58009-06-6 (Cyclohexanone, 2-acetyl-3-ethyl-)
58009-06-6 structure
Product Name:Cyclohexanone, 2-acetyl-3-ethyl-
CAS No:58009-06-6
MF:C10H16O2
MW:168.232843399048
CID:343505
PubChem ID:22748291
Update Time:2025-04-19
Cyclohexanone, 2-acetyl-3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 2-acetyl-3-ethyl-
- 2-acetyl-3-ethylcyclohexan-1-one
- SCHEMBL11527216
- 58009-06-6
- DTXSID20628028
-
- Inchi： 1S/C10H16O2/c1-3-8-5-4-6-9(12)10(8)7(2)11/h8,10H,3-6H2,1-2H3
- InChI Key： LEHQUCJMWXEZEL-UHFFFAOYSA-N
- SMILES： O=C1CCCC(CC)C1C(C)=O
Computed Properties
- Exact Mass: 168.11508
- Monoisotopic Mass: 168.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 196
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
Cyclohexanone, 2-acetyl-3-ethyl- Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
58009-06-6 (Cyclohexanone, 2-acetyl-3-ethyl-) Related Products
- 823-76-7(1-cyclohexylethan-1-one)
- 96184-81-5(4-Oxocyclohexanecarbaldehyde)
- 10458-14-7(Menthone)
- 18362-64-6(2,6-Dimethyl-3,5-heptanedione)
- 4341-24-6(5-Methylcyclohexane-1,3-dione)
- 700-58-3(Adamantanone)
- 14765-30-1(2-Sec-Butylcyclohexanone)
- 1193-55-1(2-Methylcyclohexane-1,3-dione)
- 874-23-7(2-acetylcyclohexan-1-one)
- 583-60-8(2-Methylcyclohexanone)
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