Cas no 2460490-25-7 (3,5-bis(methyl-d3)pyridin-2,6-d2-4-ol)
2460490-25-7 structure
Product Name:3,5-bis(methyl-d3)pyridin-2,6-d2-4-ol
CAS No:2460490-25-7
MF:C7H9NO
MW:131.201755285263
CID:6825410
PubChem ID:172401766
Update Time:2025-02-28
3,5-bis(methyl-d3)pyridin-2,6-d2-4-ol Chemical and Physical Properties
Names and Identifiers
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- 2460490-25-7
- CS-23529
- 3,5-bis(methyl-d3)pyridin-2,6-d2-4-ol
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- Inchi： 1S/C7H9NO/c1-5-3-8-4-6(2)7(5)9/h3-4H,1-2H3,(H,8,9)/i1D3,2D3,3D,4D
- InChI Key： NFHMKDLDCGOXMF-PIODKIDGSA-N
- SMILES： OC1C(=C([2H])N=C([2H])C=1C([2H])([2H])[2H])C([2H])([2H])[2H]
Computed Properties
- Exact Mass: 131.118627878Da
- Monoisotopic Mass: 131.118627878Da
- Isotope Atom Count: 8
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 84.9
- 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: 1.2
- Topological Polar Surface Area: 33.1?2
3,5-bis(methyl-d3)pyridin-2,6-d2-4-ol Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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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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