Cas no 4481-49-6 (2,4-Dioxabicyclo[3.2.2]nonan-3-one)
![2,4-Dioxabicyclo[3.2.2]nonan-3-one structure](https://ossimg.kuujia.com/scimg/4500/4481-49-6x500.png)
4481-49-6 structure
Product Name:2,4-Dioxabicyclo[3.2.2]nonan-3-one
CAS No:4481-49-6
MF:C7H10O3
MW:142.152502536774
CID:333804
PubChem ID:53441025
Update Time:2025-04-19
2,4-Dioxabicyclo[3.2.2]nonan-3-one Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Dioxabicyclo[3.2.2]nonan-3-one
- 1,4-Cyclohexanediol, cycliccarbonate
- Carbonicacid, cyclic 1,4-cyclohexylene ester (8CI)
- DTXSID70702983
- 4481-49-6
-
- Inchi： 1S/C7H10O3/c8-7-9-5-1-2-6(10-7)4-3-5/h5-6H,1-4H2
- InChI Key： IRQRQLLMLGPNCP-UHFFFAOYSA-N
- SMILES： O1C(=O)OC2CCC1CC2
Computed Properties
- Exact Mass: 142.063
- Monoisotopic Mass: 142.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 131
- 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: 1.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
2,4-Dioxabicyclo[3.2.2]nonan-3-one Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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