Cas no 142022-60-4 (Benzene,1,2,3-trichloro-5-(4-nitrophenoxy)-)
142022-60-4 structure
Product Name:Benzene,1,2,3-trichloro-5-(4-nitrophenoxy)-
CAS No:142022-60-4
MF:C12H6Cl3NO3
MW:318.539940357208
CID:230131
PubChem ID:3025759
Update Time:2025-04-19
Benzene,1,2,3-trichloro-5-(4-nitrophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,2,3-trichloro-5-(4-nitrophenoxy)-
- 1,2,3-trichloro-5-(4-nitrophenoxy)benzene
- 142022-60-4
- Diphenyl ether, 3,4,5-trichloro-4'-nitro
- Benzene, 1,2,3-trichloro-5-(4-nitrophenoxy)-
- DTXSID00161928
- NS00120896
- CYTQSKBPAYNKCG-UHFFFAOYSA-N
-
- Inchi： 1S/C12H6Cl3NO3/c13-10-5-9(6-11(14)12(10)15)19-8-3-1-7(2-4-8)16(17)18/h1-6H
- InChI Key： CYTQSKBPAYNKCG-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C=C(C=1)OC1C=CC(=CC=1)[N+](=O)[O-])Cl)Cl
Computed Properties
- Exact Mass: 316.94148
- Monoisotopic Mass: 316.941326g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 306
- 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: 55?2
Experimental Properties
- PSA: 52.37
Benzene,1,2,3-trichloro-5-(4-nitrophenoxy)- 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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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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