Cas no 57054-88-3 (4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl-)
57054-88-3 structure
Product Name:4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl-
CAS No:57054-88-3
MF:C8H11BrClN3
MW:264.5500395298
CID:346756
PubChem ID:15620525
Update Time:2025-04-19
4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl- Chemical and Physical Properties
Names and Identifiers
-
- 4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl-
- 5-bromo-2-chloro-N,N-diethylpyrimidin-4-amine
- DTXSID20575881
- AKOS017342199
- SCHEMBL13649069
- 57054-88-3
-
- Inchi： 1S/C8H11BrClN3/c1-3-13(4-2)7-6(9)5-11-8(10)12-7/h5H,3-4H2,1-2H3
- InChI Key： HLTVDIWJSHPQLF-UHFFFAOYSA-N
- SMILES： BrC1=CN=C(N=C1N(CC)CC)Cl
Computed Properties
- Exact Mass: 262.98263
- Monoisotopic Mass: 262.98249g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 154
- 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: 3
- Topological Polar Surface Area: 29?2
Experimental Properties
- PSA: 29.02
4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
57054-88-3 (4-Pyrimidinamine, 5-bromo-2-chloro-N,N-diethyl-) Related Products
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