Cas no 397843-75-3 (Boronic acid, [2-[(1-oxopropyl)amino]phenyl]-)
397843-75-3 structure
Product Name:Boronic acid, [2-[(1-oxopropyl)amino]phenyl]-
CAS No:397843-75-3
MF:C9H12BNO3
MW:193.007482528687
CID:1511039
Update Time:2024-08-24
Boronic acid, [2-[(1-oxopropyl)amino]phenyl]- Chemical and Physical Properties
Names and Identifiers
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- Boronic acid, [2-[(1-oxopropyl)amino]phenyl]-
- Boronic acid, [2-[(1-oxopropyl)amino]phenyl]- (9CI)
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- Inchi: 1S/C9H12BNO3/c1-2-9(12)11-8-6-4-3-5-7(8)10(13)14/h3-6,13-14H,2H2,1H3,(H,11,12)
- InChI Key: YJOCMAAPKZMJBR-UHFFFAOYSA-N
- SMILES: C1(B(O)O)=CC=CC=C1NC(=O)CC
Computed Properties
- Exact Mass: 192.09466
Experimental Properties
- Density: 1.19±0.1 g/cm3(Predicted)
- PSA: 69.56
- pka: 8.51±0.53(Predicted)
Boronic acid, [2-[(1-oxopropyl)amino]phenyl]- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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