Cas no 2697155-89-6 (4-bromo-3,5-bis(methyl-d3)pyridine)
2697155-89-6 structure
Product Name:4-bromo-3,5-bis(methyl-d3)pyridine
CAS No:2697155-89-6
MF:C7H8BrN
MW:192.086091041565
CID:6826577
PubChem ID:172406695
Update Time:2025-02-26
4-bromo-3,5-bis(methyl-d3)pyridine Chemical and Physical Properties
Names and Identifiers
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- CS-24745
- 2697155-89-6
- 4-bromo-3,5-bis(methyl-d3)pyridine
-
- Inchi： 1S/C7H8BrN/c1-5-3-9-4-6(2)7(5)8/h3-4H,1-2H3/i1D3,2D3
- InChI Key： HYZVAVYBDNKXDG-WFGJKAKNSA-N
- SMILES： BrC1C(=CN=CC=1C([2H])([2H])[2H])C([2H])([2H])[2H]
Computed Properties
- Exact Mass: 191.02167Da
- Monoisotopic Mass: 191.02167Da
- Isotope Atom Count: 6
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- 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: 2.3
- Topological Polar Surface Area: 12.9?2
4-bromo-3,5-bis(methyl-d3)pyridine Related Literature
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
2697155-89-6 (4-bromo-3,5-bis(methyl-d3)pyridine) Related Products
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