Cas no 25314-99-2 (1-Bromo-2,6-dimethoxy-5-nitronaphthalene)
25314-99-2 structure
Product Name:1-Bromo-2,6-dimethoxy-5-nitronaphthalene
CAS No:25314-99-2
MF:C12H10BrNO4
MW:312.116102695465
CID:2661270
PubChem ID:628656
Update Time:2025-04-21
1-Bromo-2,6-dimethoxy-5-nitronaphthalene Chemical and Physical Properties
Names and Identifiers
-
- 1-bromo-2,6-dimethoxy-5-nitronaphthalene
- DTXCID20299035
- IJYZMNVYZUFQFI-UHFFFAOYSA-N
- DTXSID60347963
- 25314-99-2
- Naphthalene, 1-bromo-2,6-dimethoxy-5-nitro-
- 1-Bromo-2,6-dimethoxy-5-nitronaphthalene #
- 1-Bromo-5-nitro-2,6-dimethoxynaphthalene
- 1-Bromo-2,6-dimethoxy-5-nitronaphthalene
-
- Inchi： 1S/C12H10BrNO4/c1-17-9-5-4-8-7(11(9)13)3-6-10(18-2)12(8)14(15)16/h3-6H,1-2H3
- InChI Key： IJYZMNVYZUFQFI-UHFFFAOYSA-N
- SMILES： BrC1=C(C=CC2=C(C(=CC=C21)OC)[N+](=O)[O-])OC
Computed Properties
- Exact Mass: 310.97932Da
- Monoisotopic Mass: 310.97932Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 309
- 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: 3.6
- Topological Polar Surface Area: 64.3?2
1-Bromo-2,6-dimethoxy-5-nitronaphthalene Related Literature
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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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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