Cas no 1252678-07-1 (4'-Nitrobiphenyl-4-boronic acid)
1252678-07-1 structure
Product Name:4'-Nitrobiphenyl-4-boronic acid
CAS No:1252678-07-1
MF:C12H10BNO4
MW:243.023103237152
CID:4691336
Update Time:2023-08-15
4'-Nitrobiphenyl-4-boronic acid Chemical and Physical Properties
Names and Identifiers
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- 4'-nitrobiphenyl-4-boronic acid
- 4'-Nitro-biphenyl-4-boronicacid
- 4'-Nitrobiphenyl-4-boronic acid
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- Inchi： 1S/C12H10BNO4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h1-8,15-16H
- InChI Key： VTWDXJIAFGTGMM-UHFFFAOYSA-N
- SMILES： OB(C1C=CC(=CC=1)C1C=CC(=CC=1)[N+](=O)[O-])O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 278
- Topological Polar Surface Area: 86.3
4'-Nitrobiphenyl-4-boronic acid Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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