Cas no 4437-72-3 (2,4-Dioxaspiro[5.5]undecan-3-one)
![2,4-Dioxaspiro[5.5]undecan-3-one structure](https://ossimg.kuujia.com/scimg/4500/4437-72-3x500.png)
4437-72-3 structure
Product Name:2,4-Dioxaspiro[5.5]undecan-3-one
CAS No:4437-72-3
MF:C9H14O3
MW:170.205663204193
CID:333134
PubChem ID:53440991
Update Time:2025-04-19
2,4-Dioxaspiro[5.5]undecan-3-one Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Dioxaspiro[5.5]undecan-3-one
- 1,1-Cyclohexanedimethanol, cycliccarbonate
- Carbonic acid, cyclicester with 1,1-cyclohexanedimethanol (7CI)
- Carbonicacid, cyclic cyclohexylidenedimethylene ester (8CI)
- SCHEMBL3725149
- DTXSID70702968
- 2-oxo-1,3-dioxane-5-spirocyclohexane
- 4437-72-3
-
- Inchi： 1S/C9H14O3/c10-8-11-6-9(7-12-8)4-2-1-3-5-9/h1-7H2
- InChI Key： GNBBYCONYQUDGJ-UHFFFAOYSA-N
- SMILES： O1C(=O)OCC2(C1)CCCCC2
Computed Properties
- Exact Mass: 170.09432
- Monoisotopic Mass: 170.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 170
- 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
- Topological Polar Surface Area: 35.5A^2
- XLogP3: 2.5
Experimental Properties
- PSA: 35.53
2,4-Dioxaspiro[5.5]undecan-3-one Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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