Cas no 27811-88-7 (Benzene,trichlorodinitro- (6CI,7CI,8CI,9CI))
27811-88-7 structure
Product Name:Benzene,trichlorodinitro- (6CI,7CI,8CI,9CI)
CAS No:27811-88-7
MF:C6HCl3N2O4
MW:271.442138433456
CID:260101
PubChem ID:214168
Update Time:2025-04-19
Benzene,trichlorodinitro- (6CI,7CI,8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Benzene,trichlorodinitro- (6CI,7CI,8CI,9CI)
- 1,2,3-Trichloro-4,5-dinitrobenzene
- 1,2,3-Trichlor-4,5-dinitrobenzol
- 1,2,3-Trichloro-4,5-dinitrobenzène
- benzene, 1,2,3-trichloro-4,5-dinitro-
- Benzene, dinitrotrichloro-
- Dinitrotrichlorobenzene
- 27811-88-7
- SCHEMBL9194645
- Trichlordinitrobenzol
- Brassisan [German]
- DTXSID80182131
- Chemagro 2635
-
- Inchi： 1S/C6HCl3N2O4/c7-2-1-3(10(12)13)6(11(14)15)5(9)4(2)8/h1H
- InChI Key： AKQZAPAZPCWKJI-UHFFFAOYSA-N
- SMILES： ClC1=C(C(=CC(=C1[N+](=O)[O-])[N+](=O)[O-])Cl)Cl
Computed Properties
- Exact Mass: 269.90033
- Monoisotopic Mass: 269.9
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 279
- 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: 4.1
- Topological Polar Surface Area: 91.6?2
Experimental Properties
- Density: 1.822
- Boiling Point: 371.1°Cat760mmHg
- Flash Point: 178.2°C
- Refractive Index: 1.645
- PSA: 86.28
Benzene,trichlorodinitro- (6CI,7CI,8CI,9CI) Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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