Cas no 3024-71-3 (Benzenemethanaminium,N,N-dimethyl-N-nonyl-, chloride (1:1))
3024-71-3 structure
Product Name:Benzenemethanaminium,N,N-dimethyl-N-nonyl-, chloride (1:1)
CAS No:3024-71-3
MF:C18H32ClN
MW:297.906384468079
CID:310559
PubChem ID:23275523
Update Time:2025-04-19
Benzenemethanaminium,N,N-dimethyl-N-nonyl-, chloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanaminium,N,N-dimethyl-N-nonyl-, chloride (1:1)
- benzyl-dimethyl-nonylazanium,chloride
- 3-benzyl-2-methyldecan-2-aminium chloride
- Benzyldimethylnonylammonium chloride
- N-benzyl-N,N-dimethylnonan-1-aminium chloride
- EINECS 221-176-7
- SCHEMBL2825352
- DTXSID20952613
- NS00047017
- 3024-71-3
- octylbenzyltrimethylammonium chloride
-
- Inchi： 1S/C18H32N.ClH/c1-4-5-6-7-8-9-13-16-19(2,3)17-18-14-11-10-12-15-18;/h10-12,14-15H,4-9,13,16-17H2,1-3H3;1H/q+1;/p-1
- InChI Key： YCIAXEFELBZLQG-UHFFFAOYSA-M
- SMILES： [Cl-].[N+](C)(C)(CC1C=CC=CC=1)CCCCCCCCC
Computed Properties
- Exact Mass: 264.972
- Monoisotopic Mass: 297.222328
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 20
- Rotatable Bond Count: 9
- Complexity: 216
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 27.6
Experimental Properties
- Boiling Point: 357.2°Cat760mmHg
- Flash Point: 147.8°C
- PSA: 0
Benzenemethanaminium,N,N-dimethyl-N-nonyl-, chloride (1:1) Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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