Cas no 823198-76-1 (Pyridine, 2-bromo-6-(phenylethynyl)-, hydrochloride)
823198-76-1 structure
Product Name:Pyridine, 2-bromo-6-(phenylethynyl)-, hydrochloride
CAS No:823198-76-1
MF:C13H9BrClN
MW:294.574261426926
CID:694867
PubChem ID:71419430
Update Time:2025-04-19
Pyridine, 2-bromo-6-(phenylethynyl)-, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 2-bromo-6-(phenylethynyl)-, hydrochloride
- 2-bromo-6-(2-phenylethynyl)pyridine,hydrochloride
- DTXSID10838674
- 2-Bromo-6-(phenylethynyl)pyridine--hydrogen chloride (1/1)
- 823198-76-1
-
- Inchi： 1S/C13H8BrN.ClH/c14-13-8-4-7-12(15-13)10-9-11-5-2-1-3-6-11;/h1-8H;1H
- InChI Key： LWDIVIDLTKBXSP-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(C#CC2C=CC=CC=2)=N1.Cl
Computed Properties
- Exact Mass: 292.96069g/mol
- Monoisotopic Mass: 292.96069g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 256
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 12.9?2
Pyridine, 2-bromo-6-(phenylethynyl)-, hydrochloride Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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