Cas no 2223040-49-9 (2-(iso-Butyl)-6-cyanopyridine-4-boronic acid pinacol ester)
2223040-49-9 structure
Product Name:2-(iso-Butyl)-6-cyanopyridine-4-boronic acid pinacol ester
CAS No:2223040-49-9
MF:C16H23BN2O2
MW:286.177024126053
CID:6811521
PubChem ID:133555709
Update Time:2025-03-03
2-(iso-Butyl)-6-cyanopyridine-4-boronic acid pinacol ester Chemical and Physical Properties
Names and Identifiers
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- 2223040-49-9
- 2-(iso-Butyl)-6-cyanopyridine-4-boronic acid pinacol ester
- CS-33313
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- Inchi: 1S/C16H23BN2O2/c1-11(2)7-13-8-12(9-14(10-18)19-13)17-20-15(3,4)16(5,6)21-17/h8-9,11H,7H2,1-6H3
- InChI Key: QAXAJNGZZFJJJJ-UHFFFAOYSA-N
- SMILES: O1B(C2C=C(C#N)N=C(CC(C)C)C=2)OC(C)(C)C1(C)C
Computed Properties
- Exact Mass: 286.1852581Da
- Monoisotopic Mass: 286.1852581Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 411
- 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: 55.1?2
2-(iso-Butyl)-6-cyanopyridine-4-boronic acid pinacol ester Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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