Cas no 29608-78-4 (1,1'-Biphenyl,4-chloro-2-nitro-)
29608-78-4 structure
Product Name:1,1'-Biphenyl,4-chloro-2-nitro-
CAS No:29608-78-4
MF:C12H8ClNO2
MW:233.650422096252
CID:271494
PubChem ID:322462
Update Time:2025-04-19
1,1'-Biphenyl,4-chloro-2-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl,4-chloro-2-nitro-
- 4-chloro-2-nitro-1-phenylbenzene
- 2-nitro-4-chlorobiphenyl
- 4-Chlor-2-nitrobiphenyl
- 4-Chlor-2-nitro-biphenyl
- 4-chloro-2-nitro-biphenyl
- AC1L86I5
- NSC280071
- SureCN5214993
- DTXSID00314038
- 29608-78-4
- LFOCMKLBBPUNHA-UHFFFAOYSA-N
- NSC-280071
- SCHEMBL5214993
-
- Inchi： 1S/C12H8ClNO2/c13-10-6-7-11(12(8-10)14(15)16)9-4-2-1-3-5-9/h1-8H
- InChI Key： LFOCMKLBBPUNHA-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=C(C=1)[N+](=O)[O-])C1C=CC=CC=1
Computed Properties
- Exact Mass: 233.02444
- Monoisotopic Mass: 233.024
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 248
- 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
- Density: 1.308
- Boiling Point: 341.6°C at 760 mmHg
- Flash Point: 160.4°C
- Refractive Index: 1.614
- PSA: 43.14
1,1'-Biphenyl,4-chloro-2-nitro- Related Literature
-
I. Volovych,M. Neumann,M. Schmidt,G. Buchner,Ji-Yoon Yang,J. W?lk,T. Sottmann,R. Strey,R. Schom?cker,M. Schwarze RSC Adv. 2016 6 58279
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2. 731. Some derivatives of biphenyl and of phenanthridineB. L. Hollingsworth,V. Petrow J. Chem. Soc. 1961 3771
-
Rajib Sarkar,Fillip Kumar Sarkar,Sushmita Gajurel,Lenida Kyndiah,Mithu Saha,Amarta Kumar Pal New J. Chem. 2023 47 10659
-
Nuria Rodríguez,Lukas J. Goossen Chem. Soc. Rev. 2011 40 5030
-
5. 537. The kinetics and mechanisms of aromatic halogen substitution. Part X. Products in the chlorination of biphenyl in acetic acidG. H. Beaven,P. B. D. de la Mare,M. Hassan,E. A. Johnson,N. V. Klassen J. Chem. Soc. 1961 2749
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