Cas no 1643562-80-4 (5-Bromo-4-chloro-2-(methyl-d3)-pyrimidine)
1643562-80-4 structure
Product Name:5-Bromo-4-chloro-2-(methyl-d3)-pyrimidine
CAS No:1643562-80-4
MF:C5H4BrClN2
MW:210.474143981934
CID:6810972
PubChem ID:133554099
Update Time:2025-03-06
5-Bromo-4-chloro-2-(methyl-d3)-pyrimidine Chemical and Physical Properties
Names and Identifiers
-
- 5-Bromo-4-chloro-2-(methyl-d3)-pyrimidine
- 1643562-80-4
- CS-27921
-
- Inchi： 1S/C5H4BrClN2/c1-3-8-2-4(6)5(7)9-3/h2H,1H3/i1D3
- InChI Key： TXPSNWJFOBWSCB-FIBGUPNXSA-N
- SMILES： BrC1C=NC(C([2H])([2H])[2H])=NC=1Cl
Computed Properties
- Exact Mass: 208.94347Da
- Monoisotopic Mass: 208.94347Da
- Isotope Atom Count: 3
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 101
- 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: 2.3
- Topological Polar Surface Area: 25.8?2
5-Bromo-4-chloro-2-(methyl-d3)-pyrimidine Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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