Cas no 62579-55-9 (1,1'-Biphenyl, 3-bromo-4'-chloro-4-nitro-)
62579-55-9 structure
Product Name:1,1'-Biphenyl, 3-bromo-4'-chloro-4-nitro-
CAS No:62579-55-9
MF:C12H7BrClNO2
MW:312.546481370926
CID:439456
PubChem ID:71385038
Update Time:2025-04-19
1,1'-Biphenyl, 3-bromo-4'-chloro-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 3-bromo-4'-chloro-4-nitro-
- 2-bromo-4-(4-chlorophenyl)-1-nitrobenzene
- 3-Bromo-4'-chloro-4-nitro-1,1'-biphenyl
- 62579-55-9
- DTXSID30807281
-
- Inchi： 1S/C12H7BrClNO2/c13-11-7-9(3-6-12(11)15(16)17)8-1-4-10(14)5-2-8/h1-7H
- InChI Key： UBTWEVRLBKOSFI-UHFFFAOYSA-N
- SMILES： BrC1=C(C=CC(=C1)C1C=CC(=CC=1)Cl)[N+](=O)[O-]
Computed Properties
- Exact Mass: 310.93491
- Monoisotopic Mass: 310.93487g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 276
- 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: 4.7
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
1,1'-Biphenyl, 3-bromo-4'-chloro-4-nitro- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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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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