Cas no 55720-84-8 (1,4-Naphthalenedione, 2-(1-hydroxyethyl)-)
55720-84-8 structure
Product Name:1,4-Naphthalenedione, 2-(1-hydroxyethyl)-
CAS No:55720-84-8
MF:C12H10O3
MW:202.206003665924
CID:351053
PubChem ID:11481099
Update Time:2025-04-19
1,4-Naphthalenedione, 2-(1-hydroxyethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione, 2-(1-hydroxyethyl)-
- 2-(1-hydroxyethyl)naphthalene-1,4-dione
- SCHEMBL5817375
- DTXSID40467234
- CHEMBL2334939
- IFGYOGFPTOLNSE-UHFFFAOYSA-N
- 55720-84-8
-
- Inchi: 1S/C12H10O3/c1-7(13)10-6-11(14)8-4-2-3-5-9(8)12(10)15/h2-7,13H,1H3
- InChI Key: IFGYOGFPTOLNSE-UHFFFAOYSA-N
- SMILES: OC(C)C1=CC(C2C=CC=CC=2C1=O)=O
Computed Properties
- Exact Mass: 202.063
- Monoisotopic Mass: 202.062994177g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 330
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.9
- Topological Polar Surface Area: 54.4?2
Experimental Properties
- PSA: 54.37
1,4-Naphthalenedione, 2-(1-hydroxyethyl)- Related Literature
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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2. An investigation of the electrochemical delithiation process of carbon coated α-Fe2O3nanoparticlesAdrian Brandt,Florian Winter,Sebastian Klamor,Frank Berkemeier,Jatinkumar Rana,Rainer P?ttgen,Andrea Balducci J. Mater. Chem. A, 2013,1, 11229-11236
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
55720-84-8 (1,4-Naphthalenedione, 2-(1-hydroxyethyl)-) Related Products
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