Cas no 20117-72-0 (5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione)
![5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione structure](https://ossimg.kuujia.com/scimg/20500/20117-72-0x500.png)
20117-72-0 structure
Product Name:5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione
CAS No:20117-72-0
MF:C15H20O4
MW:264.316905021667
CID:3158248
Update Time:2025-04-08
5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione Chemical and Physical Properties
Names and Identifiers
-
- 5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione
- 1,3-Cyclohexanedione, 2,2'-methylenebis[5-methyl-
-
- MDL： MFCD01108454
- Inchi： 1S/C15H20O4/c1-8-3-12(16)10(13(17)4-8)7-11-14(18)5-9(2)6-15(11)19/h8-11H,3-7H2,1-2H3
- InChI Key： CHBAQLXFYDRYMG-UHFFFAOYSA-N
- SMILES： C(C1C(=O)CC(C)CC1=O)C1C(=O)CC(C)CC1=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
Experimental Properties
- Density: 1.136±0.06 g/cm3(Predicted)
- Melting Point: 151 °C
- Boiling Point: 459.1±40.0 °C(Predicted)
- pka: 4.90±0.25(Predicted)
5-methyl-2-[(4-methyl-2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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