Cas no 2223005-35-2 (2-(sec-Butyl-d9)-pyridine-5-boronic acid pinacol ester)
2223005-35-2 structure
Product Name:2-(sec-Butyl-d9)-pyridine-5-boronic acid pinacol ester
CAS No:2223005-35-2
MF:C15H24BNO2
MW:270.223019599915
CID:6809987
PubChem ID:133550965
Update Time:2025-03-04
2-(sec-Butyl-d9)-pyridine-5-boronic acid pinacol ester Chemical and Physical Properties
Names and Identifiers
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- 2223005-35-2
- 2-(sec-Butyl-d9)-pyridine-5-boronic acid pinacol ester
- CS-18276
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- Inchi： 1S/C15H24BNO2/c1-7-11(2)13-9-8-12(10-17-13)16-18-14(3,4)15(5,6)19-16/h8-11H,7H2,1-6H3/i1D3,2D3,7D2,11D
- InChI Key： HPVPQVTYZGRWGB-NJHCEQBWSA-N
- SMILES： O1B(C2=CN=C(C=C2)C([2H])(C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])[2H])OC(C)(C)C1(C)C
Computed Properties
- Exact Mass: 270.2464999Da
- Monoisotopic Mass: 270.2464999Da
- Isotope Atom Count: 9
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 303
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 31.4?2
2-(sec-Butyl-d9)-pyridine-5-boronic acid pinacol ester Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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