Cas no 69867-78-3 (1,4,7,10,13,16,19-Heptaoxacyclodocosane(9CI))
69867-78-3 structure
Product Name:1,4,7,10,13,16,19-Heptaoxacyclodocosane(9CI)
CAS No:69867-78-3
MF:C15H30O7
MW:322.394505977631
CID:515338
PubChem ID:71401319
Update Time:2025-04-19
1,4,7,10,13,16,19-Heptaoxacyclodocosane(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,4,7,10,13,16,19-Heptaoxacyclodocosane(9CI)
- 22-Crown-7
- 1,4,7,10,13,16,19-heptaoxacyclodocosane
- DTXSID90822455
- 69867-78-3
-
- Inchi： 1S/C15H30O7/c1-2-16-4-6-18-8-10-20-12-14-22-15-13-21-11-9-19-7-5-17-3-1/h1-15H2
- InChI Key： KMFXQOWBXXSZOY-UHFFFAOYSA-N
- SMILES： O1CCOCCOCCOCCOCCOCCOCCC1
Computed Properties
- Exact Mass: 322.1992
- Monoisotopic Mass: 322.19915329g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
- Complexity: 196
- 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: -0.5
- Topological Polar Surface Area: 64.6?2
Experimental Properties
- PSA: 64.61
1,4,7,10,13,16,19-Heptaoxacyclodocosane(9CI) Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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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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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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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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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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