Cas no 65121-76-8 (Phenol,2-methyl-4,6-dinitro-, lead(2+) salt (2:1))
65121-76-8 structure
Product Name:Phenol,2-methyl-4,6-dinitro-, lead(2+) salt (2:1)
CAS No:65121-76-8
MF:C14H10N4O10Pb
MW:601.450000286102
CID:503207
PubChem ID:105185
Update Time:2025-04-19
Phenol,2-methyl-4,6-dinitro-, lead(2+) salt (2:1) Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-methyl-4,6-dinitro-, lead(2+) salt (2:1)
- lead(2+) 4,6-dinitro-o-cresolate
- lead(2+) bis(2-methyl-4,6-dinitrophenolate)
- 65121-76-8
- 2-Methyl-4,6-dinitrophenol lead(2+) salt (2:1)
- EINECS 265-460-9
- DTXSID401319311
-
- Inchi： 1S/2C7H6N2O5.Pb/c2*1-4-2-5(8(11)12)3-6(7(4)10)9(13)14;/h2*2-3,10H,1H3;/q;;+2/p-2
- InChI Key： GCEXLEGHSWACSY-UHFFFAOYSA-L
- SMILES： [Pb+2].[O-]C1C(=CC(=CC=1C)[N+](=O)[O-])[N+](=O)[O-].[O-]C1C(=CC(=CC=1C)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 685.9923
- Monoisotopic Mass: 198.027671
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 245
- 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: 2.1
- Topological Polar Surface Area: 112
Experimental Properties
- Melting Point: 86.5 deg C
- Boiling Point: 332.4°C at 760 mmHg
- Flash Point: 149.2°C
- PSA: 293.28
Phenol,2-methyl-4,6-dinitro-, lead(2+) salt (2:1) Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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