Cas no 917613-23-1 (1,4-Dioxaspiro[4.5]decane-2-acetaldehyde, 3-oxo-, (2S)-)
917613-23-1 structure
Product Name:1,4-Dioxaspiro[4.5]decane-2-acetaldehyde, 3-oxo-, (2S)-
CAS No:917613-23-1
MF:C10H14O4
MW:198.215763568878
CID:785500
PubChem ID:57342243
Update Time:2025-04-19
1,4-Dioxaspiro[4.5]decane-2-acetaldehyde, 3-oxo-, (2S)- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Dioxaspiro[4.5]decane-2-acetaldehyde, 3-oxo-, (2S)-
- 2-[(2S)-3-oxo-1,4-dioxaspiro[4.5]decan-2-yl]acetaldehyde
- DTXSID10720944
- [(2S)-3-Oxo-1,4-dioxaspiro[4.5]decan-2-yl]acetaldehyde
- 917613-23-1
-
- Inchi: 1S/C10H14O4/c11-7-4-8-9(12)14-10(13-8)5-2-1-3-6-10/h7-8H,1-6H2/t8-/m0/s1
- InChI Key: RRUHESYIEAZOPW-QMMMGPOBSA-N
- SMILES: O1[C@@H](CC=O)C(=O)OC21CCCCC2
Computed Properties
- Exact Mass: 198.08920892g/mol
- Monoisotopic Mass: 198.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 243
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 52.6?2
1,4-Dioxaspiro[4.5]decane-2-acetaldehyde, 3-oxo-, (2S)- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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5. 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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