Cas no 860034-13-5 (Boronic acid, (5-cyano-2-nitrophenyl)-)
860034-13-5 structure
Product Name:Boronic acid, (5-cyano-2-nitrophenyl)-
CAS No:860034-13-5
MF:C7H5BN2O4
MW:191.936601400375
CID:1843887
PubChem ID:86061423
Update Time:2025-04-21
Boronic acid, (5-cyano-2-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Boronic acid, (5-cyano-2-nitrophenyl)-
- B-(5-Cyano-2-nitrophenyl)boronic acid
- DTXSID801287110
- DB-415689
- (5-Cyano-2-nitrophenyl)boronic acid
- 860034-13-5
-
- Inchi： 1S/C7H5BN2O4/c9-4-5-1-2-7(10(13)14)6(3-5)8(11)12/h1-3,11-12H
- InChI Key： CCDBEDZKWQIRKB-UHFFFAOYSA-N
- SMILES： OB(C1C=C(C#N)C=CC=1[N+](=O)[O-])O
Computed Properties
- Exact Mass: 192.0342368g/mol
- Monoisotopic Mass: 192.0342368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 269
- 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: 110?2
Boronic acid, (5-cyano-2-nitrophenyl)- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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