Cas no 2241865-94-9 (2-(methyl-d3)pyrimidin-4,6-d2-5-amine)
2241865-94-9 structure
Product Name:2-(methyl-d3)pyrimidin-4,6-d2-5-amine
CAS No:2241865-94-9
MF:C5H7N3
MW:114.159988641739
CID:6825462
PubChem ID:172406415
Update Time:2025-03-03
2-(methyl-d3)pyrimidin-4,6-d2-5-amine Chemical and Physical Properties
Names and Identifiers
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- 2241865-94-9
- CS-23584
- 2-(methyl-d3)pyrimidin-4,6-d2-5-amine
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- Inchi： 1S/C5H7N3/c1-4-7-2-5(6)3-8-4/h2-3H,6H2,1H3/i1D3,2D,3D
- InChI Key： VGPRNGGSKJHOFE-RHIBPKLGSA-N
- SMILES： N1C([2H])=C(C([2H])=NC=1C([2H])([2H])[2H])N
Computed Properties
- Exact Mass: 114.095380966Da
- Monoisotopic Mass: 114.095380966Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 66.1
- 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: -0.1
- Topological Polar Surface Area: 51.8?2
2-(methyl-d3)pyrimidin-4,6-d2-5-amine Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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