Cas no 68791-17-3 (5-Bromo-4,6-dichloropyrimidine)
68791-17-3 structure
Product Name:5-Bromo-4,6-dichloropyrimidine
CAS No:68791-17-3
MF:C4HBrCl2N2
MW:227.874137639999
CID:4668319
Update Time:2023-08-14
5-Bromo-4,6-dichloropyrimidine Chemical and Physical Properties
Names and Identifiers
-
- 5-Bromo-4,6-dichloropyrimidine
- Pyrimidine, 5-bromo-4,6-dichloro-
- 5-bromo-4,6-dichloro-pyrimidine
- PubChem6899
- AMY483
- BBL102776
- KM1224
- STL556582
- BC003202
- SY006162
- 797B615
- Z1695906738
-
- Inchi： 1S/C4HBrCl2N2/c5-2-3(6)8-1-9-4(2)7/h1H
- InChI Key： BKLHHTTZTSYHBV-UHFFFAOYSA-N
- SMILES： BrC1=C(N=CN=C1Cl)Cl
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 92.6
- XLogP3: 2.8
- Topological Polar Surface Area: 25.8
Experimental Properties
- Density: 1.28±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Slightly soluble (3.2 g/l) (25 o C),
5-Bromo-4,6-dichloropyrimidine Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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