Cas no 2259315-73-4 (4-chloro-6-(methyl-d3)pyrimidine-2,5-d2)
2259315-73-4 structure
Product Name:4-chloro-6-(methyl-d3)pyrimidine-2,5-d2
CAS No:2259315-73-4
MF:C5H5ClN2
MW:133.590408086777
CID:6820416
PubChem ID:172400884
Update Time:2025-03-01
4-chloro-6-(methyl-d3)pyrimidine-2,5-d2 Chemical and Physical Properties
Names and Identifiers
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- 4-chloro-6-(methyl-d3)pyrimidine-2,5-d2
- 2259315-73-4
- CS-22073
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- Inchi： 1S/C5H5ClN2/c1-4-2-5(6)8-3-7-4/h2-3H,1H3/i1D3,2D,3D
- InChI Key： MVAXKFAQKTWRAH-RHIBPKLGSA-N
- SMILES： ClC1=C([2H])C(C([2H])([2H])[2H])=NC([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: 1.5
- Topological Polar Surface Area: 25.8?2
4-chloro-6-(methyl-d3)pyrimidine-2,5-d2 Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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