Cas no 477593-44-5 (5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine)
477593-44-5 structure
Product Name:5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine
CAS No:477593-44-5
MF:C9H10BrClN2O2
MW:293.544900417328
CID:2646422
PubChem ID:58890912
Update Time:2025-04-21
5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine Chemical and Physical Properties
Names and Identifiers
-
- DB-107395
- SCHEMBL13649063
- 477593-44-5
- AKOS017625871
- 5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine
-
- Inchi： 1S/C9H10BrClN2O2/c10-7-5-12-9(11)13-8(7)15-6-1-3-14-4-2-6/h5-6H,1-4H2
- InChI Key： BEFNWGYMVBZWTF-UHFFFAOYSA-N
- SMILES： BrC1=CN=C(N=C1OC1CCOCC1)Cl
Computed Properties
- Exact Mass: 291.96142Da
- Monoisotopic Mass: 291.96142Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 205
- 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: 2.6
- Topological Polar Surface Area: 44.2?2
5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
477593-44-5 (5-Bromo-2-chloro-4-(oxan-4-yloxy)pyrimidine) Related Products
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