Cas no 4753-58-6 (Oxacycloundecane-2,7-dione)
Oxacycloundecane-2,7-dione structure
Product Name:Oxacycloundecane-2,7-dione
CAS No:4753-58-6
MF:C10H16O3
MW:184.232243537903
CID:2693476
PubChem ID:544252
Update Time:2025-04-21
Oxacycloundecane-2,7-dione Chemical and Physical Properties
Names and Identifiers
-
- oxacycloundecane-2,7-dione
- 4753-58-6
- DTXCID70288813
- DTXSID40337726
- 1-oxacycloundecane-2,7-quinone
- Oxacycloundecane-2,7-dione
-
- Inchi： 1S/C10H16O3/c11-9-5-1-2-7-10(12)13-8-4-3-6-9/h1-8H2
- InChI Key： KITKBQHYNLJQSF-UHFFFAOYSA-N
- SMILES： O1C(CCCCC(CCCC1)=O)=O
Computed Properties
- Exact Mass: 184.109944368Da
- Monoisotopic Mass: 184.109944368Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 187
- 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
- Topological Polar Surface Area: 43.4?2
Oxacycloundecane-2,7-dione Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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