Cas no 89597-18-2 (Anthracene, 1-methyl-3-nitro-)
Anthracene, 1-methyl-3-nitro- structure
Product Name:Anthracene, 1-methyl-3-nitro-
CAS No:89597-18-2
MF:C15H11NO2
MW:237.253343820572
CID:595287
PubChem ID:54543
Update Time:2025-04-19
Anthracene, 1-methyl-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Anthracene, 1-methyl-3-nitro-
- 1-methyl-3-nitroanthracene
- 89597-18-2
- 80191-43-1
- Anthracene, methylnitro-
- DTXSID601001091
-
- Inchi： 1S/C15H11NO2/c1-10-6-14(16(17)18)8-13-7-11-4-2-3-5-12(11)9-15(10)13/h2-9H,1H3
- InChI Key： LERBQXUGAVZDOF-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC(C)=C2C=C3C=CC=CC3=CC2=C1)=O
Computed Properties
- Exact Mass: 237.078978594g/mol
- Monoisotopic Mass: 237.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 0
- Complexity: 325
- 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: 4.4
- Topological Polar Surface Area: 45.8?2
Anthracene, 1-methyl-3-nitro- Related Literature
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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