Cas no 918413-80-6 (Boronic acid, B-(2-cyano-5-formylphenyl)-)
918413-80-6 structure
Product Name:Boronic acid, B-(2-cyano-5-formylphenyl)-
CAS No:918413-80-6
MF:C8H6BNO3
MW:174.949141979218
CID:776538
PubChem ID:15942030
Update Time:2025-04-19
Boronic acid, B-(2-cyano-5-formylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Boronic acid, B-(2-cyano-5-formylphenyl)-
- (2-cyano-5-formylphenyl)boronic acid
- DTXSID40580018
- AB59540
- AKOS006305788
- 918413-80-6
- starbld0019297
-
- Inchi： 1S/C8H6BNO3/c10-4-7-2-1-6(5-11)3-8(7)9(12)13/h1-3,5,12-13H
- InChI Key： BVYVLTMIKIKMCJ-UHFFFAOYSA-N
- SMILES： OB(C1C(C#N)=CC=C(C=O)C=1)O
Computed Properties
- Exact Mass: 175.0440732g/mol
- Monoisotopic Mass: 175.0440732g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 235
- 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: 81.3?2
Boronic acid, B-(2-cyano-5-formylphenyl)- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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