Cas no 73356-06-6 (1,4-Naphthalenedione, 2-cyclooctyl-3-hydroxy-)
73356-06-6 structure
Product Name:1,4-Naphthalenedione, 2-cyclooctyl-3-hydroxy-
CAS No:73356-06-6
MF:C18H20O3
MW:284.349605560303
CID:542601
PubChem ID:44332485
Update Time:2025-04-19
1,4-Naphthalenedione, 2-cyclooctyl-3-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione, 2-cyclooctyl-3-hydroxy-
- 3-cyclooctyl-4-hydroxynaphthalene-1,2-dione
- DTXSID60658324
- CHEMBL103230
- SCHEMBL11120067
- 73356-06-6
-
- Inchi： 1S/C18H20O3/c19-16-13-10-6-7-11-14(13)17(20)18(21)15(16)12-8-4-2-1-3-5-9-12/h6-7,10-12,19H,1-5,8-9H2
- InChI Key： ITCWSSHAQFKSDL-UHFFFAOYSA-N
- SMILES： OC1C2C=CC=CC=2C(C(C=1C1CCCCCCC1)=O)=O
Computed Properties
- Exact Mass: 284.141
- Monoisotopic Mass: 284.141
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 455
- 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
- Topological Polar Surface Area: 54.4A^2
- XLogP3: 4.5
1,4-Naphthalenedione, 2-cyclooctyl-3-hydroxy- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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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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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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