Cas no 2294950-71-1 (2-chloro-4-(methyl-d3)-1,3,5-triazine-6-d)
2294950-71-1 structure
Product Name:2-chloro-4-(methyl-d3)-1,3,5-triazine-6-d
CAS No:2294950-71-1
MF:C4H4ClN3
MW:133.572305679321
CID:6824216
PubChem ID:172405902
Update Time:2025-03-01
2-chloro-4-(methyl-d3)-1,3,5-triazine-6-d Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-4-(methyl-d3)-1,3,5-triazine-6-d
- CS-22283
- 2294950-71-1
-
- Inchi： 1S/C4H4ClN3/c1-3-6-2-7-4(5)8-3/h2H,1H3/i1D3,2D
- InChI Key： WALTZQPCFRFJHG-MZCSYVLQSA-N
- SMILES： ClC1=NC([2H])=NC(C([2H])([2H])[2H])=N1
Computed Properties
- Exact Mass: 133.0344818Da
- Monoisotopic Mass: 133.0344818Da
- Isotope Atom Count: 4
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 77.7
- 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: 1.3
- Topological Polar Surface Area: 38.7?2
2-chloro-4-(methyl-d3)-1,3,5-triazine-6-d Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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