Cas no 89291-18-9 (Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]-)
![Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]- structure](https://ossimg.kuujia.com/scimg/89500/89291-18-9x500.png)
89291-18-9 structure
Product Name:Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]-
CAS No:89291-18-9
MF:C12H21BN2O2
MW:236.118343114853
CID:605283
PubChem ID:13196744
Update Time:2025-04-19
Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]-
- [2,6-bis[(dimethylamino)methyl]phenyl]boronic acid
- starbld0019226
- {2,6-Bis[(dimethylamino)methyl]phenyl}boronic acid
- 89291-18-9
- (2,6-Bis((dimethylamino)methyl)phenyl)boronic acid
- DTXSID50526462
-
- Inchi： 1S/C12H21BN2O2/c1-14(2)8-10-6-5-7-11(9-15(3)4)12(10)13(16)17/h5-7,16-17H,8-9H2,1-4H3
- InChI Key： DAKUDWQOAVXJES-UHFFFAOYSA-N
- SMILES： OB(C1C(=CC=CC=1CN(C)C)CN(C)C)O
Computed Properties
- Exact Mass: 236.1696081g/mol
- Monoisotopic Mass: 236.1696081g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 207
- 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: 46.9?2
Experimental Properties
- PSA: 46.94000
- LogP: -0.51040
Boronic acid, [2,6-bis[(dimethylamino)methyl]phenyl]- Related Literature
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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