Cas no 17162-99-1 (8-Hydroxyoctane-2,5-dione)
8-Hydroxyoctane-2,5-dione structure
Product Name:8-Hydroxyoctane-2,5-dione
CAS No:17162-99-1
MF:C8H14O3
MW:158.194962978363
CID:2781956
Update Time:2023-08-07
8-Hydroxyoctane-2,5-dione Chemical and Physical Properties
Names and Identifiers
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- 8-Hydroxyoctane-2,5-dione
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- Inchi： 1S/C8H14O3/c1-7(10)4-5-8(11)3-2-6-9/h9H,2-6H2,1H3
- InChI Key： OBJOTDVEAXMVID-UHFFFAOYSA-N
- SMILES： O=C(CCC(C)=O)CCCO
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 140
- XLogP3: -0.9
- Topological Polar Surface Area: 54.4
8-Hydroxyoctane-2,5-dione Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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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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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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