Cas no 122364-53-8 (Cyclohexanone, 3,3,5-trimethyl-5-propyl-)
122364-53-8 structure
Product Name:Cyclohexanone, 3,3,5-trimethyl-5-propyl-
CAS No:122364-53-8
MF:C12H22O
MW:182.302484035492
CID:1214050
PubChem ID:19084544
Update Time:2025-04-20
Cyclohexanone, 3,3,5-trimethyl-5-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanone, 3,3,5-trimethyl-5-propyl-
- 3,3,5-trimethyl-5-propylcyclohexan-1-one
- 122364-53-8
- SCHEMBL7749976
- DTXSID10597916
-
- Inchi： 1S/C12H22O/c1-5-6-12(4)8-10(13)7-11(2,3)9-12/h5-9H2,1-4H3
- InChI Key： YJYAWHZIAIPEFU-UHFFFAOYSA-N
- SMILES： O=C1CC(C)(C)CC(C)(CCC)C1
Computed Properties
- Exact Mass: 182.167065321g/mol
- Monoisotopic Mass: 182.167065321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 205
- 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: 3.7
- Topological Polar Surface Area: 17.1?2
Cyclohexanone, 3,3,5-trimethyl-5-propyl- Related Literature
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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
122364-53-8 (Cyclohexanone, 3,3,5-trimethyl-5-propyl-) 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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