Cas no 2891517-36-3 (1-(methyl-d3)-1H-pyrazol-3,5-d2-4-amine)
2891517-36-3 structure
Product Name:1-(methyl-d3)-1H-pyrazol-3,5-d2-4-amine
CAS No:2891517-36-3
MF:C4H7N3
MW:102.149288415909
CID:6827874
PubChem ID:172405525
Update Time:2025-02-15
1-(methyl-d3)-1H-pyrazol-3,5-d2-4-amine Chemical and Physical Properties
Names and Identifiers
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- CS-26155
- 1-(methyl-d3)-1H-pyrazol-3,5-d2-4-amine
- 2891517-36-3
-
- Inchi: 1S/C4H7N3/c1-7-3-4(5)2-6-7/h2-3H,5H2,1H3/i1D3,2D,3D
- InChI Key: LBGSWBJURUFGLR-RHIBPKLGSA-N
- SMILES: N1(C([2H])([2H])[2H])C([2H])=C(C([2H])=N1)N
Computed Properties
- Exact Mass: 102.095380966Da
- Monoisotopic Mass: 102.095380966Da
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 64
- 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: -0.4
- Topological Polar Surface Area: 43.8?2
1-(methyl-d3)-1H-pyrazol-3,5-d2-4-amine Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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