Cas no 825637-09-0 (3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)-)
825637-09-0 structure
Product Name:3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)-
CAS No:825637-09-0
MF:C16H30O
MW:238.408805370331
CID:688018
PubChem ID:71418051
Update Time:2025-04-19
3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)-
- 1-(2,2,6,6-tetramethylcyclohexyl)hexan-3-one
- 825637-09-0
- DTXSID60837379
-
- Inchi： 1S/C16H30O/c1-6-8-13(17)9-10-14-15(2,3)11-7-12-16(14,4)5/h14H,6-12H2,1-5H3
- InChI Key： ARFJCZXAJLBJFL-UHFFFAOYSA-N
- SMILES： O=C(CCC)CCC1C(C)(C)CCCC1(C)C
Computed Properties
- Exact Mass: 238.229665576g/mol
- Monoisotopic Mass: 238.229665576g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 247
- 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: 5.1
- Topological Polar Surface Area: 17.1?2
3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
825637-09-0 (3-Hexanone, 1-(2,2,6,6-tetramethylcyclohexyl)-) Related Products
- 589-92-4(4-methylcyclohexan-1-one)
- 40649-36-3(4-propylcyclohexan-1-one)
- 5441-51-0(4-ethylcyclohexan-1-one)
- 2979-19-3(3,3-dimethylcyclohexan-1-one)
- 61203-83-6(4-Pentylcyclohexanone)
- 84868-02-0(4-(trans-4-Pentylcyclohexyl)cyclohexanone)
- 82832-73-3(4-(trans-4'-Propylcyclohexyl)cyclohexan-1-one)
- 1660-04-4(1-(1-adamantyl)ethanone)
- 559-74-0(Friedelin)
- 98-53-3(4-tert-butylcyclohexan-1-one)
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