Cas no 167764-85-4 (BORONIC ACID, [2,6-DIFLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL)PHENYL]-)
167764-85-4 structure
Product Name:BORONIC ACID, [2,6-DIFLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL)PHENYL]-
CAS No:167764-85-4
MF:C15H21BF2O2
MW:282.133851766586
CID:3398669
PubChem ID:10967956
Update Time:2025-04-21
BORONIC ACID, [2,6-DIFLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL)PHENYL]- Chemical and Physical Properties
Names and Identifiers
-
- BORONIC ACID, [2,6-DIFLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL)PHENYL]-
- (2,6-Difluoro-4-(4-propylcyclohexyl)phenyl)boronic acid
- B-[2,6-Difluoro-4-(trans-4-propylcyclohexyl)phenyl]boronic acid
- SCHEMBL8339233
- SCHEMBL8339235
- 167764-85-4
- DTXSID001175189
-
- Inchi: 1S/C15H21BF2O2/c1-2-3-10-4-6-11(7-5-10)12-8-13(17)15(16(19)20)14(18)9-12/h8-11,19-20H,2-7H2,1H3
- InChI Key: WEYZFFUQDANBFR-UHFFFAOYSA-N
- SMILES: FC1C(B(O)O)=C(C=C(C=1)C1CCC(CCC)CC1)F
Computed Properties
- Exact Mass: 282.1602664Da
- Monoisotopic Mass: 282.1602664Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 284
- 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: 40.5?2
BORONIC ACID, [2,6-DIFLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL)PHENYL]- Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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