Cas no 1185309-28-7 (5-Bromopyrimidine-2-d1)
5-Bromopyrimidine-2-d1 structure
Product Name:5-Bromopyrimidine-2-d1
CAS No:1185309-28-7
MF:C4H3BrN2
MW:159.990181207657
CID:6810980
PubChem ID:45785460
Update Time:2025-03-28
5-Bromopyrimidine-2-d1 Chemical and Physical Properties
Names and Identifiers
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- AKOS015944510
- 5-Bromopyrimidine-2-d1
- CS-18685
- 1185309-28-7
-
- Inchi： 1S/C4H3BrN2/c5-4-1-6-3-7-2-4/h1-3H/i3D
- InChI Key： GYCPLYCTMDTEPU-WFVSFCRTSA-N
- SMILES： BrC1=CN=C([2H])N=C1
Computed Properties
- Exact Mass: 158.95424Da
- Monoisotopic Mass: 158.95424Da
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 51.7
- 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: 0.7
- Topological Polar Surface Area: 25.8?2
5-Bromopyrimidine-2-d1 Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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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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