Cas no 2806718-61-4 (4-bromo-3-(methyl-d3)pyridine)
4-bromo-3-(methyl-d3)pyridine structure
Product Name:4-bromo-3-(methyl-d3)pyridine
CAS No:2806718-61-4
MF:C6H6BrN
MW:175.04102563858
CID:6827122
PubChem ID:172404984
Update Time:2025-02-19
4-bromo-3-(methyl-d3)pyridine Chemical and Physical Properties
Names and Identifiers
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- 2806718-61-4
- 4-bromo-3-(methyl-d3)pyridine
- CS-25382
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- Inchi： 1S/C6H6BrN/c1-5-4-8-3-2-6(5)7/h2-4H,1H3/i1D3
- InChI Key： GYUAOSJIGMDMNJ-FIBGUPNXSA-N
- SMILES： BrC1C=CN=CC=1C([2H])([2H])[2H]
Computed Properties
- Exact Mass: 173.98719Da
- Monoisotopic Mass: 173.98719Da
- Isotope Atom Count: 3
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- 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: 1.9
- Topological Polar Surface Area: 12.9?2
4-bromo-3-(methyl-d3)pyridine Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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