Cas no 718642-33-2 (Borinic acid, (3-cyanophenyl)ethenyl-)
718642-33-2 structure
Product Name:Borinic acid, (3-cyanophenyl)ethenyl-
CAS No:718642-33-2
MF:C9H7BNO
MW:155.968981981277
CID:544909
Update Time:2023-08-03
Borinic acid, (3-cyanophenyl)ethenyl- Chemical and Physical Properties
Names and Identifiers
-
- Borinic acid, (3-cyanophenyl)ethenyl-
- 2-(3-cyanophenyl)ethenyl-hydroxyboron
- [2-(3-Cyanophenyl)ethenyl](hydroxy)boranyl
-
- Inchi： 1S/C9H7BNO/c11-7-9-3-1-2-8(6-9)4-5-10-12/h1-6,12H
- InChI Key： ISIPVOPHMSYSTJ-UHFFFAOYSA-N
- SMILES： O[B]C=CC1C=CC=C(C#N)C=1 |^1:1|
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 206
- Topological Polar Surface Area: 44
Borinic acid, (3-cyanophenyl)ethenyl- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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