Cas no 100593-23-5 (Pyrene,1-nitro-8-nitroso-)
Pyrene,1-nitro-8-nitroso- structure
Product Name:Pyrene,1-nitro-8-nitroso-
CAS No:100593-23-5
MF:C16H8N2O3
MW:276.24632358551
CID:185719
PubChem ID:108093
Update Time:2025-04-19
Pyrene,1-nitro-8-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- Pyrene,1-nitro-8-nitroso-
- 1-Nitro-8-nitrosopyrene
- 1-Nitroso-8-nitropyrene
- CCRIS 2587
- 100593-23-5
- Pyrene, 1-nitro-8-nitroso-
- L-nitroso-8-nitropyrene
- DTXSID90143410
-
- Inchi： 1S/C16H8N2O3/c19-17-13-7-3-9-1-2-10-4-8-14(18(20)21)12-6-5-11(13)15(9)16(10)12/h1-8H
- InChI Key： PAJDGJYLNJGDDA-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC=C2C=CC3=CC=C(C4=CC=C1C2=C43)N=O)=O
Computed Properties
- Exact Mass: 276.05354
- Monoisotopic Mass: 276.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 0
- Complexity: 449
- 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: 4.2
- Topological Polar Surface Area: 75.2?2
Experimental Properties
- PSA: 72.57
Pyrene,1-nitro-8-nitroso- Security Information
- Safety Term：x."> Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
Pyrene,1-nitro-8-nitroso- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Xinyi Liu,Huan Chen,Jing Lin,Yi Li,Liangqia Guo Chem. Commun., 2019,55, 2972-2975
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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5. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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