Cas no 150473-03-3 (Chrysene, 3-nitroso-)
Chrysene, 3-nitroso- structure
Product Name:Chrysene, 3-nitroso-
CAS No:150473-03-3
MF:C18H11NO
MW:257.286044359207
CID:195615
PubChem ID:3025842
Update Time:2025-04-19
Chrysene, 3-nitroso- Chemical and Physical Properties
Names and Identifiers
-
- Chrysene, 3-nitroso-
- 3-nitrosochrysene
- DTXSID40164559
- 150473-03-3
-
- Inchi： 1S/C18H11NO/c20-19-14-8-5-13-7-9-16-15-4-2-1-3-12(15)6-10-17(16)18(13)11-14/h1-11H
- InChI Key： CQZZESXMYMNTMF-UHFFFAOYSA-N
- SMILES： O=NC1C=CC2=CC=C3C4C=CC=CC=4C=CC3=C2C=1
Computed Properties
- Exact Mass: 257.08413
- Monoisotopic Mass: 257.084064
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 0
- Complexity: 368
- 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
- Topological Polar Surface Area: 29.4
- XLogP3: 5
Experimental Properties
- Density: 1.22
- Boiling Point: 494.8°Cat760mmHg
- Flash Point: 203.3°C
- Refractive Index: 1.677
- PSA: 29.43
Chrysene, 3-nitroso- Related Literature
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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