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MedKoo Cat#: 596087 | Name: Phenyltrimethylammonium tribromide
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

Phenyltrimethylammonium tribromide is a Versatile Reagent in Organic Synthesis

Chemical Structure

Phenyltrimethylammonium tribromide
Phenyltrimethylammonium tribromide
CAS#4207-56-1

Theoretical Analysis

MedKoo Cat#: 596087

Name: Phenyltrimethylammonium tribromide

CAS#: 4207-56-1

Chemical Formula: C9H14I3N

Exact Mass: 516.8260

Molecular Weight: 516.93

Elemental Analysis: C, 20.91; H, 2.73; I, 73.65; N, 2.71

Price and Availability

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25g USD 350.00 2 Weeks
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Synonym
Phenyltrimethylammonium tribromide; EINECS 224-127-8; NSC 87897; NSC87897; NSC-87897; NSC 173340; NSC-173340; NSC173340; Trimethylphenylammonium tribromide; Phenyltrimethylammonium tribromide; Ammonium, trimethylphenyl-, (tribromide);
IUPAC/Chemical Name
Benzenaminium, N,N,N-trimethyl-, (tribromide)
InChi Key
RHXJPCQWYPXLEH-UHFFFAOYSA-N
InChi Code
InChI=1S/C9H14N.I3/c1-10(2,3)9-7-5-4-6-8-9;1-3-2/h4-8H,1-3H3;/q+1;-1
SMILES Code
C[N+](C)(C)C1=CC=CC=C1.I[I-]I
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info
Product Data
Product Data
Instruction
View handling instruction
Biological target:
Phenyltrimethylammonium tribromide is a Versatile Reagent in Organic Synthesis
In vitro activity:
Herein, phenyltrimethylammonium (PTA+) is successfully employed as the organic interlayer spacer to prepare the 2D Ruddlesden-Popper perovskite films that exhibit exceptional optoelectronic properties. By adding Cl- ions during film growth, the (PTA)2(MA)3Pb4I13 (MA = methylammonium) perovskite films are effectively prepared with a tunable crystal orientation and film morphology. Moreover, the PTA-based 2D perovskite solar cells demonstrate remarkable environmental and thermal stabilities. Reference: Nano Lett. 2019 Aug 14;19(8):5237-5245. https://pubmed.ncbi.nlm.nih.gov/31369277/
In vivo activity:
TBD

Preparing Stock Solutions

The following data is based on the product molecular weight 516.93 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Formulation protocol:
1. Li Z, Liu N, Meng K, Liu Z, Hu Y, Xu Q, Wang X, Li S, Cheng L, Chen G. A New Organic Interlayer Spacer for Stable and Efficient 2D Ruddlesden-Popper Perovskite Solar Cells. Nano Lett. 2019 Aug 14;19(8):5237-5245. doi: 10.1021/acs.nanolett.9b01652. Epub 2019 Aug 6. PMID: 31369277. 2. Kaluđerović LM, Tomić ZP, Ašanin DP, Đurović-Pejčev RD, Kresović BJ. Examination of the influence of phenyltrimethylammonium chloride (PTMA) concentration on acetochlor adsorption by modified montmorillonite. J Environ Sci Health B. 2018 Aug 3;53(8):503-509. doi: 10.1080/03601234.2018.1462930. Epub 2018 Apr 30. PMID: 29708850.
In vitro protocol:
1. Li Z, Liu N, Meng K, Liu Z, Hu Y, Xu Q, Wang X, Li S, Cheng L, Chen G. A New Organic Interlayer Spacer for Stable and Efficient 2D Ruddlesden-Popper Perovskite Solar Cells. Nano Lett. 2019 Aug 14;19(8):5237-5245. doi: 10.1021/acs.nanolett.9b01652. Epub 2019 Aug 6. PMID: 31369277. 2. Kaluđerović LM, Tomić ZP, Ašanin DP, Đurović-Pejčev RD, Kresović BJ. Examination of the influence of phenyltrimethylammonium chloride (PTMA) concentration on acetochlor adsorption by modified montmorillonite. J Environ Sci Health B. 2018 Aug 3;53(8):503-509. doi: 10.1080/03601234.2018.1462930. Epub 2018 Apr 30. PMID: 29708850.
In vivo protocol:
TBD
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PubMed PMID: 28504148. 4: Jolin WC, Goyetche R, Carter K, Medina J, Vasudevan D, MacKay AA. Predicting Organic Cation Sorption Coefficients: Accounting for Competition from Sorbed Inorganic Cations Using a Simple Probe Molecule. Environ Sci Technol. 2017 Jun 6;51(11):6193-6201. doi: 10.1021/acs.est.7b01277. Epub 2017 May 10. PubMed PMID: 28459593. 5: Hahn RZ, Antunes MV, Costa Arnhold P, Andriguetti NB, Verza SG, Linden R. Determination of topiramate in dried blood spots using single-quadrupole gas chromatography-mass spectrometry after flash methylation with trimethylanilinium hydroxide. J Chromatogr B Analyt Technol Biomed Life Sci. 2017 Mar 1;1046:131-137. doi: 10.1016/j.jchromb.2017.01.047. Epub 2017 Feb 1. PubMed PMID: 28178597. 6: Jolin WC, Sullivan J, Vasudevan D, MacKay AA. Column Chromatography To Obtain Organic Cation Sorption Isotherms. Environ Sci Technol. 2016 Aug 2;50(15):8196-204. doi: 10.1021/acs.est.6b01733. Epub 2016 Jul 19. PubMed PMID: 27379799. 7: Uemura T, Yamaguchi M, Chatani N. Phenyltrimethylammonium Salts as Methylation Reagents in the Nickel-Catalyzed Methylation of C-H Bonds. Angew Chem Int Ed Engl. 2016 Feb 24;55(9):3162-5. doi: 10.1002/anie.201511197. Epub 2016 Jan 28. PubMed PMID: 26821872. 8: Wang H, Zhao X, Meng W, Wang P, Wu F, Tang Z, Han X, Giesy JP. Cetyltrimethylammonium Bromide-Coated Fe₃O₄ Magnetic Nanoparticles for Analysis of 15 Trace Polycyclic Aromatic Hydrocarbons in Aquatic Environments by Ultraperformance, Liquid Chromatography With Fluorescence Detection. Anal Chem. 2015 Aug 4;87(15):7667-75. doi: 10.1021/acs.analchem.5b01077. Epub 2015 Jul 22. PubMed PMID: 26153060. 9: Berchel M, Le Gall T, Haelters JP, Lehn P, Montier T, Jaffrès PA. Cationic lipophosphoramidates containing a hydroxylated polar headgroup for improving gene delivery. Mol Pharm. 2015 Jun 1;12(6):1902-10. doi: 10.1021/mp500807k. Epub 2015 May 18. PubMed PMID: 25941755. 10: Dutta A, Singh N. Surfactant-modified bentonite clays: preparation, characterization, and atrazine removal. Environ Sci Pollut Res Int. 2015 Mar;22(5):3876-85. doi: 10.1007/s11356-014-3656-3. Epub 2014 Oct 3. PubMed PMID: 25273519. 11: King EB, Hartsock JJ, O'Leary SJ, Salt AN. Influence of cochleostomy and cochlear implant insertion on drug gradients following intratympanic application in Guinea pigs. Audiol Neurootol. 2013;18(5):307-16. doi: 10.1159/000353534. Epub 2013 Sep 5. PubMed PMID: 24008355; PubMed Central PMCID: PMC3872819. 12: Fraser D, DeRoo CS, Cody RB, Armitage RA. Characterization of blood in an encrustation on an African mask: spectroscopic and direct analysis in real time mass spectrometric identification of haem. Analyst. 2013 Aug 21;138(16):4470-4. doi: 10.1039/c3an00633f. Epub 2013 Jun 18. PubMed PMID: 23775114. 13: Salt AN, Hartsock JJ, Gill RM, Piu F, Plontke SK. Perilymph pharmacokinetics of markers and dexamethasone applied and sampled at the lateral semi-circular canal. J Assoc Res Otolaryngol. 2012 Dec;13(6):771-83. doi: 10.1007/s10162-012-0347-y. Epub 2012 Sep 12. PubMed PMID: 22968908; PubMed Central PMCID: PMC3505589. 14: Salt AN, King EB, Hartsock JJ, Gill RM, O'Leary SJ. Marker entry into vestibular perilymph via the stapes following applications to the round window niche of guinea pigs. Hear Res. 2012 Jan;283(1-2):14-23. doi: 10.1016/j.heares.2011.11.012. Epub 2011 Dec 8. PubMed PMID: 22178981; PubMed Central PMCID: PMC3277668. 15: Jaynes WF, Zartman RE. Aflatoxin toxicity reduction in feed by enhanced binding to surface-modified clay additives. Toxins (Basel). 2011 Jun;3(6):551-65. doi: 10.3390/toxins3060551. Epub 2011 Jun 10. PubMed PMID: 22069725; PubMed Central PMCID: PMC3202849. 16: Manzano E, Rodriguez-Simón LR, Navas N, Checa-Moreno R, Romero-Gámez M, Capitan-Vallvey LF. Study of the GC-MS determination of the palmitic-stearic acid ratio for the characterisation of drying oil in painting: La Encarnación by Alonso Cano as a case study. Talanta. 2011 May 30;84(4):1148-54. doi: 10.1016/j.talanta.2011.03.012. Epub 2011 Mar 16. PubMed PMID: 21530791. 17: Petrů K, Jáč P, Lužová V, Kuneš J, Polášek M. Determination of muscle relaxants pancuronium and vecuronium bromide by capillary electrophoresis with capacitively coupled contactless conductivity detection. Electrophoresis. 2011 Apr;32(8):890-5. doi: 10.1002/elps.201000456. Epub 2011 Mar 10. PubMed PMID: 21394728. 18: Amphaisri K, Palit M, Mallard G. Thermally assisted methylation and subsequent silylation of scheduled acids of chemical weapon convention for on-site analysis and its comparison with the other methods of methylation. J Chromatogr A. 2011 Feb 18;1218(7):972-80. doi: 10.1016/j.chroma.2010.12.065. Epub 2010 Dec 23. PubMed PMID: 21215410. 19: Trigo C, Koskinen WC, Celis R, Sadowsky MJ, Hermosín MC, Cornejo J. Bioavailability of organoclay formulations of atrazine in soil. J Agric Food Chem. 2010 Nov 24;58(22):11857-63. doi: 10.1021/jf102909y. Epub 2010 Oct 22. PubMed PMID: 20964437. 20: Jensen TJ, Vicente MG, Luguya R, Norton J, Fronczek FR, Smith KM. Effect of overall charge and charge distribution on cellular uptake, distribution and phototoxicity of cationic porphyrins in HEp2 cells. J Photochem Photobiol B. 2010 Aug 2;100(2):100-11. doi: 10.1016/j.jphotobiol.2010.05.007. Epub 2010 May 23. PubMed PMID: 20558079; PubMed Central PMCID: PMC3161426.