Cas no 61653-18-7 (6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1))
61653-18-7 structure
Product Name:6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1)
CAS No:61653-18-7
MF:C15H11N5O6
MW:357.277742624283
CID:471362
PubChem ID:71393747
Update Time:2025-04-19
6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1)
- quinolin-6-amine,1,3,5-trinitrobenzene
- Quinolin-6-amine--1,3,5-trinitrobenzene (1/1)
- DTXSID40815498
- 61653-18-7
-
- Inchi： 1S/C9H8N2.C6H3N3O6/c10-8-3-4-9-7(6-8)2-1-5-11-9;10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-6H,10H2;1-3H
- InChI Key： WCVLCUHBTCPLQW-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=C(C=1)[N+](=O)[O-])[N+](=O)[O-])=O.N1C=CC=C2C=C(C=CC=12)N
Computed Properties
- Exact Mass: 357.07103
- Monoisotopic Mass: 357.07093309g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 26
- Rotatable Bond Count: 0
- Complexity: 365
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 176?2
Experimental Properties
- PSA: 168.33
6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1) Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
61653-18-7 (6-Quinolinamine, compd. with 1,3,5-trinitrobenzene (1:1)) Related Products
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