(Tri-n-butyl)-n-tetradecylphosphonium chloride - ≥97% , CAS No.81741-28-8

CAS: 81741-28-8 Cat. No.: T121853 Molecular Weight: 435.16 EC Number: 279-808-2 PubChem CID: 9889168

GRADE & PURITY ≥97%

Synonyms

Tributyl tetradecyl phosphonium chloride | W-111555 | AKOS015833154 | NCGC00259558-01 | Tributyltetradecylphosphonium chloride | Tributyl-tetradecylphosphonium chloride | (Tri-n-Butyl)-n-Tetradecylphosphonium Chloride | FT-0688175 | Tox21_303556 | UNII-82

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

Tributyl tetradecyl phosphonium chloride | W-111555 | AKOS015833154 | NCGC00259558-01 | Tributyltetradecylphosphonium chloride | Tributyl-tetradecylphosphonium chloride | (Tri-n-Butyl)-n-Tetradecylphosphonium Chloride | FT-0688175 | Tox21_303556 | UNII-82

Specifications & Purity

≥97%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Cl-]
• IUPAC Name: tributyl(tetradecyl)phosphanium;chloride
• InChIKey: AKUNSPZHHSNFFX-UHFFFAOYSA-M
• INCHI: 1S/C26H56P.ClH/c1-5-9-13-14-15-16-17-18-19-20-21-22-26-27(23-10-6-2,24-11-7-3)25-12-8-4;/h5-26H2,1-4H3;1H/q+1;/p-1
• Isomeric SMILES: CCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC.[Cl-]
• PubChem CID: 9889168
• Molecular Weight: 435.16

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organophosphorus compounds
    • Class Tetraalkylphosphonium compounds

• Kingdom: Organic compounds
• Superclass: Organophosphorus compounds
• Class: Tetraalkylphosphonium compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylphosphonium compounds
• Alternative Parents: Organopnictogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylphosphonium compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as tetraalkylphosphonium compounds. These are organophosphorus compounds that contain a tetravalent phosphorus atom substituted to four alkyl chains.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: air sensitive；Moisture sensitive.
• Molecular Weight: 435.100 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 22
• Exact Mass: 434.381 Da
• Monoisotopic Mass: 434.381 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 252.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Xueshan Sun, Xuezhen Wang, Yingli Wan, Yafei Guo, Tianlong Deng, Xiaoping Yu.  (2022)  Synthesis of functional ionic liquids with high extraction rate and electroconductivity for lithium-magnesium separation and metallic magnesium production from salt lake brine.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.139610]

2. Chengcheng Yu, Xu Hu, Shichao Lu, Yangchuan Ke, Jianbin Luo.  (2021)  Preparation of Triple-Functionalized Montmorillonite Layers Promoting Thermal Stability of Polystyrene.  Nanomaterials,  11  (9): (2170).  [PMID:34578483] [10.3390/nano11092170]

3. Pei Yuanchao, Cao Yuan, Huang Yanjie, Song Xinxin, Wang Huiyong, Zhao Yuling, Wang Jianji.  (2016)  Tunable LCST-type phase behavior of [FeCl4]--based ionic liquids in water.  Science China-Chemistry,  59  (5): (587-593).  [PMID:] [10.1007/s11426-016-5577-0]

4. Chengcheng Yu, Yangchuan Ke, Xu Hu, Yi Zhao, Qingchun Deng, Shichao Lu.  (2019)  Effect of Bifunctional Montmorillonite on the Thermal and Tribological Properties of Polystyrene/Montmorillonite Nanocomposites.  Polymers,  11  (5): (834).  [PMID:31071984] [10.3390/polym11050834]