Cas no 37673-87-3 (Pyrimidine, 2-chloro-5-nitro-4,6-diphenyl-)
37673-87-3 structure
Product Name:Pyrimidine, 2-chloro-5-nitro-4,6-diphenyl-
CAS No:37673-87-3
MF:C16H10ClN3O2
MW:311.722502231598
CID:1485616
PubChem ID:12025856
Update Time:2025-04-21
Pyrimidine, 2-chloro-5-nitro-4,6-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine, 2-chloro-5-nitro-4,6-diphenyl-
- 2-chloro-5-nitro-4,6-diphenylpyrimidine
- DTXSID20476026
- 37673-87-3
-
- Inchi： 1S/C16H10ClN3O2/c17-16-18-13(11-7-3-1-4-8-11)15(20(21)22)14(19-16)12-9-5-2-6-10-12/h1-10H
- InChI Key： MGYLCZUFMMDOSC-UHFFFAOYSA-N
- SMILES： ClC1=NC(C2C=CC=CC=2)=C(C(C2C=CC=CC=2)=N1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 311.0463
- Monoisotopic Mass: 311.0461543g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 350
- 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: 4.3
- Topological Polar Surface Area: 71.6?2
Experimental Properties
- PSA: 68.92
Pyrimidine, 2-chloro-5-nitro-4,6-diphenyl- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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