Cas no 7473-18-9 (1,4-Naphthalenedione,2-ethoxy-)
7473-18-9 structure
Product Name:1,4-Naphthalenedione,2-ethoxy-
CAS No:7473-18-9
MF:C12H10O3
MW:202.206003665924
CID:579330
PubChem ID:343758
Update Time:2025-04-19
1,4-Naphthalenedione,2-ethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione,2-ethoxy-
- 2-ethoxynaphthalene-1,4-dione
- 2-Aethoxy-[1,4]naphthochinon
- 2-Aethoxy-naphthochinon-(1.4)
- 2-ethoxy-[1,4]naphthoquinone
- 2-ethoxy-1,4-naphthoquinone
- AC1L7Z1E
- CHEMBL240964
- NSC400246
- SureCN2511730
- 7473-18-9
- NSC-400246
- SCHEMBL2511730
- 1,4-Naphthalenedione, 2-ethoxy-
- AKOS024385026
- XRYOPZBKBPUTKS-UHFFFAOYSA-N
- DTXSID10322028
-
- Inchi: 1S/C12H10O3/c1-2-15-11-7-10(13)8-5-3-4-6-9(8)12(11)14/h3-7H,2H2,1H3
- InChI Key: XRYOPZBKBPUTKS-UHFFFAOYSA-N
- SMILES: O(CC)C1=CC(C2C=CC=CC=2C1=O)=O
Computed Properties
- Exact Mass: 202.063
- Monoisotopic Mass: 202.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 317
- 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
Experimental Properties
- Density: 1.23
- Boiling Point: 350.5°Cat760mmHg
- Flash Point: 156.9°C
- Refractive Index: 1.578
- PSA: 43.37
- LogP: 1.98600
1,4-Naphthalenedione,2-ethoxy- Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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