Cas no 14095-64-8 (Pyrimidine,5-butyl-2,4,6-trichloro-)
14095-64-8 structure
Product Name:Pyrimidine,5-butyl-2,4,6-trichloro-
CAS No:14095-64-8
MF:C8H9Cl3N2
MW:239.529458761215
CID:212201
PubChem ID:260782
Update Time:2025-04-19
Pyrimidine,5-butyl-2,4,6-trichloro- Chemical and Physical Properties
Names and Identifiers
-
- Pyrimidine,5-butyl-2,4,6-trichloro-
- 2-n-Butyl-5,6-dimethyl-pyrazin
- 2-Thiophenesulfonamide, 5-butyl-N-(1,1-dimethylethyl)-
- 5-butyl-2-(N-t-butylaminosulfonyl)thiophene
- 5-butyl-2,3-dimethylpyrazine
- 5-butyl-2,3-dimethyl-pyrazine
- 5-butyl-2,4,6-trichloro-pyrimidine
- 5-Butyl-2,4,6-trichlor-pyrimidin
- ACMC-20n4po
- AGN-PC-00JFG7
- CTK0E9414
- SureCN708647
- NSC-92496
- 5-butyl-2,4,6-trichloropyrimidine
- DTXSID90930963
- SCHEMBL11862558
- 14095-64-8
- NSC92496
-
- Inchi： 1S/C8H9Cl3N2/c1-2-3-4-5-6(9)12-8(11)13-7(5)10/h2-4H2,1H3
- InChI Key： GMUMNOPSIBDNAB-UHFFFAOYSA-N
- SMILES： ClC1C(=C(N=C(N=1)Cl)Cl)CCCC
Computed Properties
- Exact Mass: 237.98337
- Monoisotopic Mass: 237.983131g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 144
- 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: 5
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- PSA: 25.78
Pyrimidine,5-butyl-2,4,6-trichloro- Related Literature
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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