Cas no 54044-92-7 (1,1'-Biphenyl, 4'-chloro-3-nitro-)
54044-92-7 structure
Product Name:1,1'-Biphenyl, 4'-chloro-3-nitro-
CAS No:54044-92-7
MF:C12H8ClNO2
MW:233.650422096252
CID:355694
PubChem ID:12244816
Update Time:2025-04-19
1,1'-Biphenyl, 4'-chloro-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 4'-chloro-3-nitro-
- 1-(4-chlorophenyl)-3-nitrobenzene
- 54044-92-7
- DTXSID20482147
- SCHEMBL5049033
- 4'-chloro-3-nitrobiphenyl
-
- Inchi： 1S/C12H8ClNO2/c13-11-6-4-9(5-7-11)10-2-1-3-12(8-10)14(15)16/h1-8H
- InChI Key： YVIAICBJQPHHLM-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1C=CC=C(C=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 233.02444
- Monoisotopic Mass: 233.0243562g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 246
- 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: 4.5
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- PSA: 43.14
1,1'-Biphenyl, 4'-chloro-3-nitro- Related Literature
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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