Cas no 2363787-76-0 (5-bromo-4-chloropyrimidine-2,6-d2)
2363787-76-0 structure
Product Name:5-bromo-4-chloropyrimidine-2,6-d2
CAS No:2363787-76-0
MF:C4H2BrClN2
MW:195.441401958466
CID:6825210
PubChem ID:172406363
Update Time:2025-03-01
5-bromo-4-chloropyrimidine-2,6-d2 Chemical and Physical Properties
Names and Identifiers
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- 2363787-76-0
- CS-23316
- 5-bromo-4-chloropyrimidine-2,6-d2
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- Inchi： 1S/C4H2BrClN2/c5-3-1-7-2-8-4(3)6/h1-2H/i1D,2D
- InChI Key： WTVLUSWQWGHYIS-QDNHWIQGSA-N
- SMILES： BrC1=C([2H])N=C([2H])N=C1Cl
Computed Properties
- Exact Mass: 193.92154Da
- Monoisotopic Mass: 193.92154Da
- Isotope Atom Count: 2
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 80.4
- 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: 1.9
- Topological Polar Surface Area: 25.8?2
5-bromo-4-chloropyrimidine-2,6-d2 Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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