Cas no 53385-72-1 (Pyridinium, 1-pentyl-, bromide)
53385-72-1 structure
Product Name:Pyridinium, 1-pentyl-, bromide
CAS No:53385-72-1
MF:C10H16BrN
MW:230.144742012024
CID:357415
PubChem ID:13908588
Update Time:2025-04-19
Pyridinium, 1-pentyl-, bromide Chemical and Physical Properties
Names and Identifiers
-
- Pyridinium, 1-pentyl-, bromide
- 1-pentylpyridin-1-ium,bromide
- N-pentylpyridinium Bromide
- 1-PENTYLPYRIDIN-1-IUM BROMIDE
- 1-n-pentylpyridinium bromide
- JOEPKDCJDKHSFJ-UHFFFAOYSA-M
- DTXSID80552330
- SCHEMBL1884891
- 53385-72-1
-
- Inchi： 1S/C10H16N.BrH/c1-2-3-5-8-11-9-6-4-7-10-11;/h4,6-7,9-10H,2-3,5,8H2,1H3;1H/q+1;/p-1
- InChI Key： JOEPKDCJDKHSFJ-UHFFFAOYSA-M
- SMILES： [Br-].[N+]1(C=CC=CC=1)CCCCC
Computed Properties
- Exact Mass: 212.9214
- Monoisotopic Mass: 229.04661g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 84.9
- 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: 3.9?2
Experimental Properties
- PSA: 3.88
Pyridinium, 1-pentyl-, bromide Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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