Cas no 88847-13-6 (9H-Carbazole, 1,2,6,8-tetranitro-)
88847-13-6 structure
Product Name:9H-Carbazole, 1,2,6,8-tetranitro-
CAS No:88847-13-6
MF:C12H5N5O8
MW:347.196801900864
CID:620735
PubChem ID:71320376
Update Time:2025-04-19
9H-Carbazole, 1,2,6,8-tetranitro- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Carbazole, 1,2,6,8-tetranitro-
- 1,2,6,8-tetranitro-9H-carbazole
- 88847-13-6
- DTXSID70750323
-
- Inchi： 1S/C12H5N5O8/c18-14(19)5-3-7-6-1-2-8(15(20)21)12(17(24)25)11(6)13-10(7)9(4-5)16(22)23/h1-4,13H
- InChI Key： VJWZJIVIYKFFBO-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=C(C=CC2=C1NC1C(=CC(=CC2=1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 347.01381213g/mol
- Monoisotopic Mass: 347.01381213g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 25
- Rotatable Bond Count: 0
- Complexity: 607
- 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: 2.7
- Topological Polar Surface Area: 199?2
9H-Carbazole, 1,2,6,8-tetranitro- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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