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5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide is a complex organic compound with the molecular formula C21H21BF2N3O. It features a dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium core structure, which is a type of heterocyclic compound with a boron atom. The molecule is characterized by the presence of two fluorine atoms at the 5-position, a formyl group (aldehyde) at the 8-position, and a phenyl group at the 10-position. Additionally, it has four methyl groups at the 1, 3, 7, and 9 positions, contributing to its overall structure and properties. 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide is likely to be of interest in the field of organic chemistry, potentially for its unique reactivity or as a building block in the synthesis of more complex molecules.

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  • 1189166-58-2 Structure
  • Basic information

    1. Product Name: 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide
    2. Synonyms: 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide
    3. CAS NO:1189166-58-2
    4. Molecular Formula:
    5. Molecular Weight: 352.191
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1189166-58-2.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide(1189166-58-2)
    11. EPA Substance Registry System: 5,5-difluoro-8-formyl-1,3,7,9-tetramethyl-10-phenyl-5H-dipyrrolo[1,2-c:2',1'-f][1,3,2]diazaborinin-4-ium-5-uide(1189166-58-2)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1189166-58-2(Hazardous Substances Data)

1189166-58-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 1189166-58-2 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,1,8,9,1,6 and 6 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 1189166-58:
(9*1)+(8*1)+(7*8)+(6*9)+(5*1)+(4*6)+(3*6)+(2*5)+(1*8)=192
192 % 10 = 2
So 1189166-58-2 is a valid CAS Registry Number.

1189166-58-2Relevant articles and documents

A diaminomaleonitrile-appended BODIPY chemosensor for the selective detection of Cu2+ via oxidative cyclization and imaging in SiHa cells and zebrafish

Li, Xiaochuan,Han, Yujie,Sun, Saisai,Shan, Dandan,Ma, Xiaoming,He, Guangjie,Mergu, Naveen,Park, Jong-Su,Kim, Cheol-Hee,Son, Young-A

, (2020)

A specific Cu2+ sensor, 2-amino-3-(BODIPYmethyleneamino)maleonitrile (BDM), was established by a simple dehydration between BODIPY and diaminomaleonitrile. Cu2+ could be recognized by BDM over other competing metal ions in acetonitri

Modulation of the Photophysical Properties of β-substituted BODIPY Dyes

More, Ankush B.,Chakraborty, Goutam,Mula, Soumyaditya,Ray, Alok K.,Sekar, Nagaiyan

, p. 381 - 392 (2018)

Photophysical properties of BODIPY dyes containing acetyl acetone and benzoyl acetone BF2 unit as an electron accepting substituent at beta position linked via double bond have been investigated using a wide range of solvents of different polarities. The substitution effect at beta position of the BODIPY dyes on their absorption, emission and quantum yield of fluorescence have been the aim of present study. For the synthesized BODIPY dyes fluorescence quantum yields and lifetimes show very sharp decrease with an increase in the solvent polarity, suggesting the involvement of highly polar ICT state de-excitation mechanism along with the local excitation process. The polarity dependent changes in average fluorescence life time and quantum yield values rationalize the formation of ICT states.

PET-based bisBODIPY photosensitizers for highly efficient excited triplet state and singlet oxygen generation: Tuning photosensitizing ability by dihedral angles

Zhang, Xian-Fu,Yang, Xudong,Xu, Baomin

, p. 24792 - 24804 (2017)

Herein, four covalent BODIPY heterodimers that differ by dihedral angles were shown to be highly efficient excited triplet state (T1) photosensitizers (PSs) for singlet oxygen formation with a quantum yield (ΦΔ) of up to 0.94 as comp

An oxidative cyclization reaction based fluorescent “Turn-On” probe for highly selective and rapid detection of hypochlorous acid

Chen, Bo,Fu, Hongyu,Lv, Yaohong,Li, Xin,Han, Yifeng

, p. 1116 - 1120 (2018)

A novel fluorescent turn-on probe, PHC1, for the detection of hypochlorous acid has been developed based on hypochlorous acid-initiated oxidative intramolecular cyclization. Endowed by the fast reaction rate, PHC1 features rapid detection kinetics, as wel

A new chromo-fluorogenic probe based on BODIPY for NO2 detection in air

Juárez, L. Alberto,Costero, Ana M.,Parra, Margarita,Gil, Salvador,Sancenón, Félix,Martínez-Má?ez, Ramón

, p. 1725 - 1727 (2015)

A novel colorimetric probe for the selective and sensitive detection of NO2 in solution and in air based on a BODIPY core containing an oxime group has been prepared.

Significant emission red-shift of BODIPY derivatives with strong electron-acceptor attached

Li, Xiaochuan,Sun, Saisai,Kim, Ick Jin,Son, Young-A.

, p. 139 - 145 (2017)

A new red-fluorescent BODIPY derivative is designed and synthesized, which is configured by attaching an electron-withdrawing unit 2-dicyanomethylene-3-cyano-4,5,5-trimethyl-2,5-dihydrofuran (TCF). By virtue of the strong electron-accepting nature of TCF unit, the compound BT exhibits a large red-shift both in absorption and emission. In contrast to parent BODIPY, the absorption shifted about 90?nm. And the emission maximum shifted to red region with the peak centered around 620?nm. The CIE coordinate and fluorescence decay data uncovered its emission character. Theoretical calculation of BT confirmed that the electron density was altered dramatically by TCF and lowered the energy gap between ground state. The character of HOMO/LUMO distribution is well in agreement with that of experimental value.

An ultrafast responsive BODIPY-based fluorescent probe for the detection of endogenous hypochlorite in live cells

Qiao, Liang,Nie, Hailiang,Wu, Yulong,Xin, Fangyun,Gao, Congcong,Jing, Jing,Zhang, Xiaoling

, p. 525 - 530 (2017)

Hypochlorite plays a significant role in various physiological and pathological processes; however, its role is still less clear than the role of other reactive oxygen species. Herein, we report an ultrafast responsive (a detection limit as low as 7.5 nM. The probe was compatible in a wide pH range of 4-13. More importantly, experiments in live cells showed that the probe could penetrate the cell membrane easily and was capable of imaging endogenous and exogenous hypochlorite specifically with a fast response.

Syntheses, kinetics and thermodynamics of BODIPY-based fluorescent probes with different kinds of hydrophilic groups for the detection of biothiols

Gao, Lian-Xun,Jiang, Feng-Lei,Liu, Yi,Tian, Ming,Zhang, Lu

, (2020)

A series of BODIPY-based fluorescent probes incorporating different kinds of hydrophilic groups were synthesized for the detection of biothiols (GSH as a representative target), namely BDP (control), BDP-OH (acidic), BDP-OEG (neutral and hydrophilic) and

A sensitive BODIPY-based fluorescent probe suitable for hypochlorite detection in living cells

Li, Yuanyuan,Tang, Yong,Gao, Mengmeng,Wang, Yun,Han, Juan,Xia, Jinchen,Wang, Lei,Tang, Xu,Ni, Liang

, p. 65 - 72 (2018)

A fluorescent probe composed of BODIPY and 2,4-dinitrophenylhydrazine was designed for the detection of ClO?. The oxidizing reaction between probe and ClO? resulted in a distinct fluorescence enhancement together with a color variation from pink to orange. This probe showed excellent selectivity to ClO? among various ions including common reactive oxygen species and high sensitivity with a detection limit of 228 nM. A fast response (7 min) was observed, which made the probe a promising method in real-time detection. Furthermore, this probe was successfully applied to monitor ClO? in real-life water and living cells.

Emission behavior of perimidine attached BODIPY and its response to acid/base

Li, Xiaochuan,Sun, SaiSai,Kim, Ick Jin,Son, Young-A.

, p. 131 - 138 (2017)

A BODIPY based with perimidine attached derivative was developed and characterized. It was efficiently synthesized by condensation between aldehyde sited at β-position of BODIPY and 1,8-diamino-naphthalene. Owing to the electron-donor effect of N in heterocycle, emission was quenched completely. Upon protonation of N, the solution exhibited dramatic emission enhancement with emission peak locating at 510?nm, which is estimated to be 275-fold of initial emission. With OH? addition, it could be reverted to the emission to non-emisison state again and establish a fluorescence switch. The underlying mechanism of fluorescence “off-on” is based on the intramolecular PET, which was attested by quantum chemistry calculation approach.

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