Cas no 72562-51-7 (1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,12,14-dimethyl-)
72562-51-7 structure
Product Name:1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,12,14-dimethyl-
CAS No:72562-51-7
MF:C14H24O8
MW:320.335565567017
CID:577776
PubChem ID:326432
Update Time:2025-04-19
1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,12,14-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,12,14-dimethyl-
- 12,14-dimethyl-1,4,7,10,13,16-hexaoxacyclooctadecane-2,6-dione
- NSC-297853
- 72562-51-7
- DTXSID60315844
- NSC297853
-
- Inchi： 1S/C14H24O8/c1-11-7-17-3-5-20-13(15)9-19-10-14(16)21-6-4-18-8-12(2)22-11/h11-12H,3-10H2,1-2H3
- InChI Key： LIFIXMXXDNEKKL-UHFFFAOYSA-N
- SMILES： O1C(C)COCCOC(COCC(=O)OCCOCC1C)=O
Computed Properties
- Exact Mass: 320.14712
- Monoisotopic Mass: 320.147
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 22
- Rotatable Bond Count: 0
- Complexity: 303
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.1
- Topological Polar Surface Area: 89.5?2
Experimental Properties
- Density: 1.072
- Boiling Point: 517.6°C at 760 mmHg
- Flash Point: 229.8°C
- Refractive Index: 1.414
- PSA: 89.52
1,4,7,10,13,16-Hexaoxacyclooctadecane-2,6-dione,12,14-dimethyl- Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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