Cas no 20278-99-3 (ammonium 3,5-dinitro-o-cresolate)
20278-99-3 structure
Product Name:ammonium 3,5-dinitro-o-cresolate
CAS No:20278-99-3
MF:C7H9N3O5
MW:215.163461446762
CID:909456
PubChem ID:44151379
Update Time:2025-04-19
ammonium 3,5-dinitro-o-cresolate Chemical and Physical Properties
Names and Identifiers
-
- ammonium 3,5-dinitro-o-cresolate
- azanium,2-methyl-3,5-dinitrophenolate
- 20278-99-3
- EINECS 243-670-1
-
- Inchi： 1S/C7H6N2O5.H3N/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10;/h2-3,10H,1H3;1H3
- InChI Key： JFJVGFDLHBZUCX-UHFFFAOYSA-N
- SMILES： [O-]C1=CC(=CC(=C1C)[N+](=O)[O-])[N+](=O)[O-].[NH4+]
Computed Properties
- Exact Mass: 261.05973
- Monoisotopic Mass: 215.05422040g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 245
- 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: 116?2
Experimental Properties
- PSA: 183.14
ammonium 3,5-dinitro-o-cresolate Related Literature
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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