Cas no 1208250-22-9 ([2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid)
![[2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid structure](https://ossimg.kuujia.com/scimg/1208500/1208250-22-9x500.png)
1208250-22-9 structure
Product Name:[2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid
CAS No:1208250-22-9
MF:C7H12BN3O3
MW:196.999481201172
CID:2617282
PubChem ID:55253202
Update Time:2025-04-21
[2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid Chemical and Physical Properties
Names and Identifiers
-
- [2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid
- AKOS006287055
- (2-((3-HYDROXYPROPYL)AMINO)PYRIMIDIN-5-YL)BORONIC ACID
- AT34781
- SCHEMBL247578
- AB41342
- 1208250-22-9
- (2-[(3-HYDROXYPROPYL)AMINO]PYRIMIDIN-5-YL)BORONIC ACID
- (2-[(3-Hydroxypropyl)amino]pyrimidin-5-yl)boronicacid
-
- Inchi： 1S/C7H12BN3O3/c12-3-1-2-9-7-10-4-6(5-11-7)8(13)14/h4-5,12-14H,1-3H2,(H,9,10,11)
- InChI Key： XCVUTCBKLKURJQ-UHFFFAOYSA-N
- SMILES： OCCCNC1N=CC(B(O)O)=CN=1
Computed Properties
- Exact Mass: 197.0971714Da
- Monoisotopic Mass: 197.0971714Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 153
- 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: 98.5?2
[2-(3-hydroxypropylamino)pyrimidin-5-yl]boronic acid Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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