Cas no 57855-16-0 (2-Methoxy-7-methylnaphthalene-1,4-dione)
57855-16-0 structure
Product Name:2-Methoxy-7-methylnaphthalene-1,4-dione
CAS No:57855-16-0
MF:C12H10O3
MW:202.206003665924
CID:2833182
PubChem ID:492463
Update Time:2025-04-21
2-Methoxy-7-methylnaphthalene-1,4-dione Chemical and Physical Properties
Names and Identifiers
-
- BDBM50107005
- SCHEMBL9628489
- DTXSID80333227
- CHEMBL106915
- 2-Methoxy-7-methyl-[1,4]naphthoquinone
- 57855-16-0
- 2-methoxy-7-methyl-naphthalene-1,4-dione
- 2-Methoxy-7-methylnaphthalene-1,4-dione
-
- Inchi： 1S/C12H10O3/c1-7-3-4-8-9(5-7)12(14)11(15-2)6-10(8)13/h3-6H,1-2H3
- InChI Key： BEAVRSYUHUFSJY-UHFFFAOYSA-N
- SMILES： O(C)C1=CC(C2=CC=C(C)C=C2C1=O)=O
Computed Properties
- Exact Mass: 202.062994177Da
- Monoisotopic Mass: 202.062994177Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- 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 : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 43.4?2
2-Methoxy-7-methylnaphthalene-1,4-dione Related Literature
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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