Cas no 2460490-24-6 (2-chloro-4-(methyl-d3)pyrimidine-5,6-d2)
2460490-24-6 structure
Product Name:2-chloro-4-(methyl-d3)pyrimidine-5,6-d2
CAS No:2460490-24-6
MF:C5H5ClN2
MW:133.590408086777
CID:6825405
PubChem ID:172403501
Update Time:2025-02-28
2-chloro-4-(methyl-d3)pyrimidine-5,6-d2 Chemical and Physical Properties
Names and Identifiers
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- 2460490-24-6
- CS-23524
- 2-chloro-4-(methyl-d3)pyrimidine-5,6-d2
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- Inchi: 1S/C5H5ClN2/c1-4-2-3-7-5(6)8-4/h2-3H,1H3/i1D3,2D,3D
- InChI Key: BHAKRVSCGILCEW-RHIBPKLGSA-N
- SMILES: ClC1=NC([2H])=C([2H])C(C([2H])([2H])[2H])=N1
Computed Properties
- Exact Mass: 133.0455096Da
- Monoisotopic Mass: 133.0455096Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 76.8
- 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: 1.6
- Topological Polar Surface Area: 25.8?2
2-chloro-4-(methyl-d3)pyrimidine-5,6-d2 Related Literature
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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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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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
2460490-24-6 (2-chloro-4-(methyl-d3)pyrimidine-5,6-d2) Related Products
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