Cas no 76917-16-3 (2-Undecanone, 1-hydroxy-)
2-Undecanone, 1-hydroxy- structure
Product Name:2-Undecanone, 1-hydroxy-
CAS No:76917-16-3
MF:C11H22O2
MW:186.291183948517
CID:537028
PubChem ID:13148246
Update Time:2025-04-19
2-Undecanone, 1-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 2-Undecanone, 1-hydroxy-
- 1-hydroxyundecan-2-one
- 76917-16-3
- DTXSID20522052
-
- Inchi： 1S/C11H22O2/c1-2-3-4-5-6-7-8-9-11(13)10-12/h12H,2-10H2,1H3
- InChI Key： ITXAKAYTXBTIFX-UHFFFAOYSA-N
- SMILES： O=C(CO)CCCCCCCCC
Computed Properties
- Exact Mass: 186.16206
- Monoisotopic Mass: 186.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 9
- Complexity: 121
- 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: 3.4
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
2-Undecanone, 1-hydroxy- Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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2. 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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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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