Cas no 165105-43-1 (2-Pyridinebutanol, 6-bromo-)
2-Pyridinebutanol, 6-bromo- structure
Product Name:2-Pyridinebutanol, 6-bromo-
CAS No:165105-43-1
MF:C9H12BrNO
MW:230.10168170929
CID:2115296
Update Time:2023-08-04
2-Pyridinebutanol, 6-bromo- Chemical and Physical Properties
Names and Identifiers
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- 6-bromo-2-Pyridinebutanol
- 2-Pyridinebutanol,6-bromo-
- 2-Pyridinebutanol, 6-bromo-
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- Inchi： 1S/C9H12BrNO/c10-9-6-3-5-8(11-9)4-1-2-7-12/h3,5-6,12H,1-2,4,7H2
- InChI Key： LLKHFFOQUYIDBU-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(CCCCO)=N1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 121
- Topological Polar Surface Area: 33.1
2-Pyridinebutanol, 6-bromo- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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