Bromuro de metiltrifenilfosfonio - ≥98% , CAS No.1779-49-3

CAS: 1779-49-3 Cat. No.: M106665 Peso molecular: 357.22 Beilstein Registry Number: 3599467 Número EC: 217-218-9

GRADE & PURITY ≥98%

Synonyms

Mops-M | methyltriphenylphosponium bromide | methyltriphenyphosphonium bromide | MFCD00011804 | 2-Methylbenzothiazol-2-amine | methyl triphenylphosphoniumbromide | methyl(triphenyl)phosphonium bromide | methyl(triphenyl)-phosphonium bromide | methyltriphe

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

Muy utilizada para la metilación mediante la reacción de Wittig. Sal de olefinación Wittig empleada recientemente en una síntesis de un enyne que, mediante metátesis de cierre de anillo, proporcionó un sistema de anillo de benzazepina.

Specifications

Sinónimos

Mops-M | methyltriphenylphosponium bromide | methyltriphenyphosphonium bromide | MFCD00011804 | 2-Methylbenzothiazol-2-amine | methyl triphenylphosphoniumbromide | methyl(triphenyl)phosphonium bromide | methyl(triphenyl)-phosphonium bromide | methyltriphe

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488184934
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184934
• Sonrisas canónicas: C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
• IUPAC Name: methyl(triphenyl)phosphanium;bromide
• InChIKey: LSEFCHWGJNHZNT-UHFFFAOYSA-M
• INCHI: 1S/C19H18P.BrH/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;/h2-16H,1H3;1H/q+1;/p-1
• Isómeros SMILES: C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
• WGK Alemania: 3
• Peso molecular: 357.22
• Beilstein: 3599467
• Reaxy-Rn: 3599467
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3599467&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylphosphines and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylphosphines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylphosphines and derivatives
• Alternative Parents: Organopnictogen compounds Organophosphorus compounds Organic bromide salts Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Triphenylphosphine - Phenylphosphine - Organopnictogen compound - Hydrocarbon derivative - Organic bromide salt - Organic salt - Organophosphorus compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylphosphines and derivatives. These are compounds containing a phenylphosphine, which consists of phosphine substituent bound to a phenyl group.
• 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

Objetivos asociados (no humanos)

Schistosoma mansoni (6170 Activities)

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Paracentrotus lividus (1138 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in water & methanol.
• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 234-235°C
• Peso molecular: 357.200 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 356.033 Da
• Monoisotopic Mass: 356.033 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 235.000
• 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

Referencias

1. Lirong Zhang, Mengyu Yang, Qianzhe Li, Zijian Zhuang, Xin Sun, Beibei Yu, Xiaonan Qiu, Qinxin Wang, Miaomiao Zhang, Fengyi Du.  (2023)  Mitochondrial-Targeted Gold-Doped Porous Carbon Nanodots for Combined Photothermal and Photodynamic Therapy of Breast Cancer.  ACS Applied Nano Materials,      [PMID:] [10.1021/acsanm.3c00953]

2. Kelong Ding, Ze-Nan Hu, Wenhui Zhang, Jiaxing Liang, Yiming Wang, Hong Li, Zejun Sun, Qionglin Liang, Hong-bin Sun.  (2022)  Bimetallic RhIn/ZIF-8 for the catalyic chemoselective hydrogenation of nitrostyrene: Exploration of natural selectivity of hydrogen sources and enhancing intrinsic selectivity.  MICROPOROUS AND MESOPOROUS MATERIALS,      [PMID:] [10.1016/j.micromeso.2022.111693]

3. Min Wang, Yajie Yue, Jingjing Zhang, Yifan Qin, Liyan Jia, Xu Jing.  (2024)  Dispersive liquid-liquid microextraction based on magnetic deep eutectic solvent for the determination of succinate dehydrogenase inhibitors in water, juice, wine, and vinegar.  JOURNAL OF FOOD COMPOSITION AND ANALYSIS,      [PMID:] [10.1016/j.jfca.2024.106411]

4. Yuxin Wang, Yulin Wang, Jizhen Fu, Suzhen Li, Yawen Zhang, Xiaojiao Zheng, Jin Liu, Li Li, Xu Jing.  (2025)  Semi-automatic emulsification liquid-liquid microextraction with deep eutectic solvent for the determination of strobilurin fungicides in food samples.  TALANTA,      [PMID:39923671] [10.1016/j.talanta.2025.127692]

5. Yiyong Chen, Qianyi He, Yuyao Yang, Shaolin Lu.  (2025)  Excitation-dependent colour modulation in Mn2+-doped hybrid perovskites: a universal strategy for luminescent anti-counterfeiting.  MATERIALS LETTERS,      [PMID:] [10.1016/j.matlet.2025.139354]

6. Zi-Lin He, Jian-Bin Luo, Jing-Hua Chen, Jun-Hua Wei, Xiao-He Miao, Zhi-Zhong Zhang, Qing-Peng Peng, Xiu-Xian Guo, Dai-Bin Kuang.  (2025)  A universal strategy toward two-component organic-inorganic metal halide luminescent glasses and glass-crystal composites.  Science Advances,  11  (22):   [PMID:40435246] [10.1126/sciadv.adu1982]

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