Cas no 19757-98-3 (1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)-)
19757-98-3 structure
Product Name:1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)-
CAS No:19757-98-3
MF:C12H18O3
MW:210.269524097443
CID:1389806
PubChem ID:11298769
Update Time:2025-04-20
1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)-
- 5,5-dimethyl-2-(3-oxobutyl)cyclohexane-1,3-dione
- starbld0009939
- VS-11768
- DTXSID50461607
- AKOS015867085
- CS-0360632
- 19757-98-3
- BBL033052
- STL236907
-
- Inchi： 1S/C12H18O3/c1-8(13)4-5-9-10(14)6-12(2,3)7-11(9)15/h9H,4-7H2,1-3H3
- InChI Key： WEKUHYLZXWCHEE-UHFFFAOYSA-N
- SMILES： O=C1C(CCC(C)=O)C(CC(C)(C)C1)=O
Computed Properties
- Exact Mass: 210.12564
- Monoisotopic Mass: 210.125594432g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 282
- 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: 0.9
- Topological Polar Surface Area: 51.2?2
Experimental Properties
- PSA: 51.21
1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)- Related Literature
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1. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Camelia Henríquez,Edwin Palacio,Víctor Cerdà Anal. Methods, 2014,6, 8494-8504
19757-98-3 (1,3-Cyclohexanedione, 5,5-dimethyl-2-(3-oxobutyl)-) Related Products
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- 1660-04-4(1-(1-adamantyl)ethanone)
- 1193-55-1(2-Methylcyclohexane-1,3-dione)
- 559-74-0(Friedelin)
- 874-23-7(2-acetylcyclohexan-1-one)
- 7307-04-2(5,5-Dimethylhexane-2,4-dione)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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