Cas no 2645418-92-2 (3-methylpyridin-4,5,6-d3-2-ol)
3-methylpyridin-4,5,6-d3-2-ol structure
Product Name:3-methylpyridin-4,5,6-d3-2-ol
CAS No:2645418-92-2
MF:C6H7NO
MW:112.144366502762
CID:6826193
PubChem ID:172406595
Update Time:2025-02-26
3-methylpyridin-4,5,6-d3-2-ol Chemical and Physical Properties
Names and Identifiers
-
- 3-methylpyridin-4,5,6-d3-2-ol
- 2645418-92-2
- CS-24349
-
- Inchi： 1S/C6H7NO/c1-5-3-2-4-7-6(5)8/h2-4H,1H3,(H,7,8)/i2D,3D,4D
- InChI Key： MVKDNXIKAWKCCS-NRUYWUNFSA-N
- SMILES： OC1C(C)=C([2H])C([2H])=C([2H])N=1
Computed Properties
- Exact Mass: 112.071594085Da
- Monoisotopic Mass: 112.071594085Da
- Isotope Atom Count: 3
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 74.9
- 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-methylpyridin-4,5,6-d3-2-ol Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
2645418-92-2 (3-methylpyridin-4,5,6-d3-2-ol) Related Products
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