Cas no 2368222-22-2 (1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8)
2368222-22-2 structure
Product Name:1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8
CAS No:2368222-22-2
MF:C16H24BNO2
MW:285.25220489502
CID:6823433
PubChem ID:172400470
Update Time:2025-03-01
1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8 Chemical and Physical Properties
Names and Identifiers
-
- CS-20318
- 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8
- 2368222-22-2
-
- Inchi: 1S/C16H24BNO2/c1-15(2)16(3,4)20-17(19-15)13-7-9-14(10-8-13)18-11-5-6-12-18/h7-10H,5-6,11-12H2,1-4H3/i5D2,6D2,7D,8D,9D,10D,11D2,12D2
- InChI Key: DWJNNJSONWFVBT-OHNKHERQSA-N
- SMILES: O1B(C2C([2H])=C([2H])C(=C([2H])C=2[2H])N2C([2H])([2H])C([2H])([2H])C([2H])([2H])C2([2H])[2H])OC(C)(C)C1(C)C
Computed Properties
- Exact Mass: 285.2653301Da
- Monoisotopic Mass: 285.2653301Da
- Isotope Atom Count: 12
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 328
- 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
- Topological Polar Surface Area: 21.7?2
1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8 Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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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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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
2368222-22-2 (1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl-2,3,5,6-d4)pyrrolidine-2,2,3,3,4,4,5,5-d8) Related Products
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