Cas no 61348-81-0 (Methanone, (4-nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)-)
61348-81-0 structure
Product Name:Methanone, (4-nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)-
CAS No:61348-81-0
MF:C13H5N5O10
MW:391.206302404404
CID:482990
PubChem ID:71396698
Update Time:2025-04-19
Methanone, (4-nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, (4-nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)-
- (4-nitro-2-nitrosophenyl)-(2,4,6-trinitrophenyl)methanone
- 61348-81-0
- DTXSID40818242
- (4-Nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)methanone
-
- Inchi： 1S/C13H5N5O10/c19-13(8-2-1-6(15(21)22)3-9(8)14-20)12-10(17(25)26)4-7(16(23)24)5-11(12)18(27)28/h1-5H
- InChI Key： MTWFKLNZPWKYKX-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(=CC=1N=O)[N+](=O)[O-])C1C(=CC(=CC=1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 391.00365
- Monoisotopic Mass: 391.00364137g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 28
- Rotatable Bond Count: 2
- Complexity: 668
- 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: 2
- Topological Polar Surface Area: 230?2
Experimental Properties
- PSA: 219.06
Methanone, (4-nitro-2-nitrosophenyl)(2,4,6-trinitrophenyl)- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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