Cas no 89101-97-3 (1,4-Dioxaspiro[4.5]decane, 7-methoxy-)
![1,4-Dioxaspiro[4.5]decane, 7-methoxy- structure](https://ossimg.kuujia.com/scimg/89500/89101-97-3x500.png)
89101-97-3 structure
Product Name:1,4-Dioxaspiro[4.5]decane, 7-methoxy-
CAS No:89101-97-3
MF:C9H16O3
MW:172.221543312073
CID:612252
PubChem ID:71322073
Update Time:2025-04-19
1,4-Dioxaspiro[4.5]decane, 7-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Dioxaspiro[4.5]decane, 7-methoxy-
- 7-methoxy-1,4-dioxaspiro[4.5]decane
- 89101-97-3
- DTXSID90751796
-
- Inchi： 1S/C9H16O3/c1-10-8-3-2-4-9(7-8)11-5-6-12-9/h8H,2-7H2,1H3
- InChI Key： PQXOGTIVELICCU-UHFFFAOYSA-N
- SMILES： O1CCOC21CCCC(C2)OC
Computed Properties
- Exact Mass: 172.109944368g/mol
- Monoisotopic Mass: 172.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 152
- 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: 0.8
- Topological Polar Surface Area: 27.7?2
1,4-Dioxaspiro[4.5]decane, 7-methoxy- Related Literature
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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